Monoterpenoids
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Monoterpenoids
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(R)-(+)-Limonene, 96%, Thermo Scientific Chemicals
CAS: 5989-27-5 Molecular Formula: C10H16 Molecular Weight (g/mol): 136.24 MDL Number: MFCD00062991 InChI Key: XMGQYMWWDOXHJM-JTQLQIEISA-N Synonym: d-limonene,+-limonene,r-+-limonene,+-4r-limonene,+-carvene,+-dipentene,citrene,+-p-mentha-1,8-diene,4r-limonene,d-+-limonene PubChem CID: 440917 ChEBI: CHEBI:15382 IUPAC Name: (4R)-1-methyl-4-prop-1-en-2-ylcyclohexene SMILES: CC(=C)[C@@H]1CCC(C)=CC1
PubChem CID | 440917 |
---|---|
CAS | 5989-27-5 |
Molecular Weight (g/mol) | 136.24 |
ChEBI | CHEBI:15382 |
MDL Number | MFCD00062991 |
SMILES | CC(=C)[C@@H]1CCC(C)=CC1 |
Synonym | d-limonene,+-limonene,r-+-limonene,+-4r-limonene,+-carvene,+-dipentene,citrene,+-p-mentha-1,8-diene,4r-limonene,d-+-limonene |
IUPAC Name | (4R)-1-methyl-4-prop-1-en-2-ylcyclohexene |
InChI Key | XMGQYMWWDOXHJM-JTQLQIEISA-N |
Molecular Formula | C10H16 |
Thermo Scientific Chemicals Thymolphthalein
CAS: 125-20-2 Molecular Formula: C28H30O4 Molecular Weight (g/mol): 430.544 MDL Number: MFCD00005909 InChI Key: LDKDGDIWEUUXSH-UHFFFAOYSA-N Synonym: thymolphthalein,thymophthalein,unii-yg5i28wsqp,yg5i28wsqp,phenolphthalein, 5',5-diisopropyl-2',2-dimethyl,3,3-bis 4-hydroxy-5-isopropyl-2-methylphenyl-2-benzofuran-1 3h-one,1 3h-isobenzofuranone, 3,3-bis 4-hydroxy-2-methyl-5-1-methylethyl phenyl,5',5-diisopropyl-2',2-dimethylphenolphthalein,3,3-bis 4-hydroxy-2-methyl-5-propan-2-ylphenyl-2-benzofuran-1-one PubChem CID: 31316 IUPAC Name: 3,3-bis(4-hydroxy-2-methyl-5-propan-2-ylphenyl)-2-benzofuran-1-one SMILES: CC1=CC(=C(C=C1C2(C3=CC=CC=C3C(=O)O2)C4=CC(=C(C=C4C)O)C(C)C)C(C)C)O
PubChem CID | 31316 |
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CAS | 125-20-2 |
Molecular Weight (g/mol) | 430.544 |
MDL Number | MFCD00005909 |
SMILES | CC1=CC(=C(C=C1C2(C3=CC=CC=C3C(=O)O2)C4=CC(=C(C=C4C)O)C(C)C)C(C)C)O |
Synonym | thymolphthalein,thymophthalein,unii-yg5i28wsqp,yg5i28wsqp,phenolphthalein, 5',5-diisopropyl-2',2-dimethyl,3,3-bis 4-hydroxy-5-isopropyl-2-methylphenyl-2-benzofuran-1 3h-one,1 3h-isobenzofuranone, 3,3-bis 4-hydroxy-2-methyl-5-1-methylethyl phenyl,5',5-diisopropyl-2',2-dimethylphenolphthalein,3,3-bis 4-hydroxy-2-methyl-5-propan-2-ylphenyl-2-benzofuran-1-one |
IUPAC Name | 3,3-bis(4-hydroxy-2-methyl-5-propan-2-ylphenyl)-2-benzofuran-1-one |
InChI Key | LDKDGDIWEUUXSH-UHFFFAOYSA-N |
Molecular Formula | C28H30O4 |
Linalool, 97%, Thermo Scientific Chemicals
CAS: 78-70-6 Molecular Formula: C10H18O Molecular Weight (g/mol): 154.25 MDL Number: MFCD00008906 InChI Key: CDOSHBSSFJOMGT-UHFFFAOYSA-N Synonym: linalool,linalol,3,7-dimethyl-1,6-octadien-3-ol,allo-ocimenol,beta-linalool,linalyl alcohol,1,6-octadien-3-ol, 3,7-dimethyl,+--linalool,p-linalool,linanool PubChem CID: 6549 ChEBI: CHEBI:17580 IUPAC Name: 3,7-dimethylocta-1,6-dien-3-ol SMILES: CC(=CCCC(C)(C=C)O)C
PubChem CID | 6549 |
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CAS | 78-70-6 |
Molecular Weight (g/mol) | 154.25 |
ChEBI | CHEBI:17580 |
MDL Number | MFCD00008906 |
SMILES | CC(=CCCC(C)(C=C)O)C |
Synonym | linalool,linalol,3,7-dimethyl-1,6-octadien-3-ol,allo-ocimenol,beta-linalool,linalyl alcohol,1,6-octadien-3-ol, 3,7-dimethyl,+--linalool,p-linalool,linanool |
IUPAC Name | 3,7-dimethylocta-1,6-dien-3-ol |
InChI Key | CDOSHBSSFJOMGT-UHFFFAOYSA-N |
Molecular Formula | C10H18O |
Thymol, 99%, Thermo Scientific Chemicals
CAS: 89-83-8 Molecular Formula: C10H14O Molecular Weight (g/mol): 150.22 MDL Number: MFCD00002309 InChI Key: MGSRCZKZVOBKFT-UHFFFAOYSA-N Synonym: thymol,2-isopropyl-5-methylphenol,5-methyl-2-isopropylphenol,thyme camphor,3-p-cymenol,6-isopropyl-m-cresol,thymic acid,isopropyl cresol,5-methyl-2-1-methylethyl phenol,6-isopropyl-3-methylphenol PubChem CID: 6989 ChEBI: CHEBI:27607 IUPAC Name: 5-methyl-2-propan-2-ylphenol SMILES: CC1=CC(=C(C=C1)C(C)C)O
PubChem CID | 6989 |
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CAS | 89-83-8 |
Molecular Weight (g/mol) | 150.22 |
ChEBI | CHEBI:27607 |
MDL Number | MFCD00002309 |
SMILES | CC1=CC(=C(C=C1)C(C)C)O |
Synonym | thymol,2-isopropyl-5-methylphenol,5-methyl-2-isopropylphenol,thyme camphor,3-p-cymenol,6-isopropyl-m-cresol,thymic acid,isopropyl cresol,5-methyl-2-1-methylethyl phenol,6-isopropyl-3-methylphenol |
IUPAC Name | 5-methyl-2-propan-2-ylphenol |
InChI Key | MGSRCZKZVOBKFT-UHFFFAOYSA-N |
Molecular Formula | C10H14O |
Linalool, 97%, Thermo Scientific Chemicals
CAS: 78-70-6 Molecular Formula: C10H18O Molecular Weight (g/mol): 154.253 MDL Number: MFCD00008906 InChI Key: CDOSHBSSFJOMGT-UHFFFAOYSA-N Synonym: linalool,linalol,3,7-dimethyl-1,6-octadien-3-ol,allo-ocimenol,beta-linalool,linalyl alcohol,1,6-octadien-3-ol, 3,7-dimethyl,+--linalool,p-linalool,linanool PubChem CID: 6549 ChEBI: CHEBI:17580 IUPAC Name: 3,7-dimethylocta-1,6-dien-3-ol SMILES: CC(=CCCC(C)(C=C)O)C
PubChem CID | 6549 |
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CAS | 78-70-6 |
Molecular Weight (g/mol) | 154.253 |
ChEBI | CHEBI:17580 |
MDL Number | MFCD00008906 |
SMILES | CC(=CCCC(C)(C=C)O)C |
Synonym | linalool,linalol,3,7-dimethyl-1,6-octadien-3-ol,allo-ocimenol,beta-linalool,linalyl alcohol,1,6-octadien-3-ol, 3,7-dimethyl,+--linalool,p-linalool,linanool |
IUPAC Name | 3,7-dimethylocta-1,6-dien-3-ol |
InChI Key | CDOSHBSSFJOMGT-UHFFFAOYSA-N |
Molecular Formula | C10H18O |
D(+)-Carvone, 98%, synthetic, Thermo Scientific Chemicals
CAS: 2244-16-8 Molecular Formula: C10H14O Molecular Weight (g/mol): 150.22 MDL Number: MFCD00062997 InChI Key: ULDHMXUKGWMISQ-VIFPVBQESA-N Synonym: d-carvone,+-carvone,s-+-carvone,s-carvone,s-2-methyl-5-prop-1-en-2-yl cyclohex-2-enone,+-s-carvone,carvone, +,d +-carvone,carvol,s-+-p-mentha-6,8-dien-2-one PubChem CID: 16724 ChEBI: CHEBI:15399 IUPAC Name: (5S)-2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-one SMILES: CC1=CCC(CC1=O)C(=C)C
PubChem CID | 16724 |
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CAS | 2244-16-8 |
Molecular Weight (g/mol) | 150.22 |
ChEBI | CHEBI:15399 |
MDL Number | MFCD00062997 |
SMILES | CC1=CCC(CC1=O)C(=C)C |
Synonym | d-carvone,+-carvone,s-+-carvone,s-carvone,s-2-methyl-5-prop-1-en-2-yl cyclohex-2-enone,+-s-carvone,carvone, +,d +-carvone,carvol,s-+-p-mentha-6,8-dien-2-one |
IUPAC Name | (5S)-2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-one |
InChI Key | ULDHMXUKGWMISQ-VIFPVBQESA-N |
Molecular Formula | C10H14O |
alpha-Terpinene, 90+%, Thermo Scientific Chemicals
CAS: 99-86-5 Molecular Formula: C10H16 Molecular Weight (g/mol): 136.24 MDL Number: MFCD00001534 InChI Key: YHQGMYUVUMAZJR-UHFFFAOYSA-N Synonym: alpha-terpinene,p-mentha-1,3-diene,terpilene,1-isopropyl-4-methyl-1,3-cyclohexadiene,1,3-cyclohexadiene, 1-methyl-4-1-methylethyl,alpha-terpinen,1-methyl-4-1-methylethyl-1,3-cyclohexadiene,1-methyl-4-isopropylcyclohexadiene-1,3,.alpha.-terpinen,.alpha.-terpinene PubChem CID: 7462 ChEBI: CHEBI:10334 IUPAC Name: 1-methyl-4-propan-2-ylcyclohexa-1,3-diene SMILES: CC(C)C1=CC=C(C)CC1
PubChem CID | 7462 |
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CAS | 99-86-5 |
Molecular Weight (g/mol) | 136.24 |
ChEBI | CHEBI:10334 |
MDL Number | MFCD00001534 |
SMILES | CC(C)C1=CC=C(C)CC1 |
Synonym | alpha-terpinene,p-mentha-1,3-diene,terpilene,1-isopropyl-4-methyl-1,3-cyclohexadiene,1,3-cyclohexadiene, 1-methyl-4-1-methylethyl,alpha-terpinen,1-methyl-4-1-methylethyl-1,3-cyclohexadiene,1-methyl-4-isopropylcyclohexadiene-1,3,.alpha.-terpinen,.alpha.-terpinene |
IUPAC Name | 1-methyl-4-propan-2-ylcyclohexa-1,3-diene |
InChI Key | YHQGMYUVUMAZJR-UHFFFAOYSA-N |
Molecular Formula | C10H16 |
Citronellol, 95%, Thermo Scientific Chemicals
CAS: 106-22-9 Molecular Formula: C10H20O Molecular Weight (g/mol): 156.27 MDL Number: MFCD00002935 InChI Key: QMVPMAAFGQKVCJ-UHFFFAOYSA-N Synonym: citronellol,beta-citronellol,3,7-dimethyl-6-octen-1-ol,dl-citronellol,cephrol,elenol,6-octen-1-ol, 3,7-dimethyl,rodinol,2,3-dihydrogeraniol,2,6-dimethyl-2-octen-8-ol PubChem CID: 8842 ChEBI: CHEBI:50462 IUPAC Name: 3,7-dimethyloct-6-en-1-ol SMILES: CC(CCC=C(C)C)CCO
PubChem CID | 8842 |
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CAS | 106-22-9 |
Molecular Weight (g/mol) | 156.27 |
ChEBI | CHEBI:50462 |
MDL Number | MFCD00002935 |
SMILES | CC(CCC=C(C)C)CCO |
Synonym | citronellol,beta-citronellol,3,7-dimethyl-6-octen-1-ol,dl-citronellol,cephrol,elenol,6-octen-1-ol, 3,7-dimethyl,rodinol,2,3-dihydrogeraniol,2,6-dimethyl-2-octen-8-ol |
IUPAC Name | 3,7-dimethyloct-6-en-1-ol |
InChI Key | QMVPMAAFGQKVCJ-UHFFFAOYSA-N |
Molecular Formula | C10H20O |
α-Terpineol, 97+%, Thermo Scientific Chemicals
CAS: 98-55-5 Molecular Formula: C10H18O Molecular Weight (g/mol): 154.25 MDL Number: MFCD00001557 InChI Key: WUOACPNHFRMFPN-UHFFFAOYSA-N Synonym: alpha-terpineol,terpineol,p-menth-1-en-8-ol,2-4-methylcyclohex-3-en-1-yl propan-2-ol,dl-alpha-terpineol,1-p-menthen-8-ol,1-menthene-8-ol,terpineol schlechthin,carvomenthenol,terpenol PubChem CID: 17100 ChEBI: CHEBI:22469 IUPAC Name: 2-(4-methylcyclohex-3-en-1-yl)propan-2-ol SMILES: CC1=CCC(CC1)C(C)(C)O
PubChem CID | 17100 |
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CAS | 98-55-5 |
Molecular Weight (g/mol) | 154.25 |
ChEBI | CHEBI:22469 |
MDL Number | MFCD00001557 |
SMILES | CC1=CCC(CC1)C(C)(C)O |
Synonym | alpha-terpineol,terpineol,p-menth-1-en-8-ol,2-4-methylcyclohex-3-en-1-yl propan-2-ol,dl-alpha-terpineol,1-p-menthen-8-ol,1-menthene-8-ol,terpineol schlechthin,carvomenthenol,terpenol |
IUPAC Name | 2-(4-methylcyclohex-3-en-1-yl)propan-2-ol |
InChI Key | WUOACPNHFRMFPN-UHFFFAOYSA-N |
Molecular Formula | C10H18O |
(R)-(-)-Carvone, 98%, Thermo Scientific Chemicals
CAS: 6485-40-1 Molecular Formula: C10H14O Molecular Weight (g/mol): 150.22 MDL Number: MFCD00001578 InChI Key: ULDHMXUKGWMISQ-SECBINFHSA-N Synonym: --carvone,l-carvone,r---carvone,l--carvone,r-2-methyl-5-prop-1-en-2-yl cyclohex-2-enone,4r-carvone,levo-carvone,--p-mentha-6,8-dien-2-one,--r-carvone PubChem CID: 439570 ChEBI: CHEBI:15400 SMILES: CC(=C)[C@@H]1CC=C(C)C(=O)C1
PubChem CID | 439570 |
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CAS | 6485-40-1 |
Molecular Weight (g/mol) | 150.22 |
ChEBI | CHEBI:15400 |
MDL Number | MFCD00001578 |
SMILES | CC(=C)[C@@H]1CC=C(C)C(=O)C1 |
Synonym | --carvone,l-carvone,r---carvone,l--carvone,r-2-methyl-5-prop-1-en-2-yl cyclohex-2-enone,4r-carvone,levo-carvone,--p-mentha-6,8-dien-2-one,--r-carvone |
InChI Key | ULDHMXUKGWMISQ-SECBINFHSA-N |
Molecular Formula | C10H14O |
(-)-Limonene, 96%, Thermo Scientific Chemicals
CAS: 5989-54-8 Molecular Formula: C10H16 Molecular Weight (g/mol): 136.24 MDL Number: MFCD00001558 InChI Key: XMGQYMWWDOXHJM-SNVBAGLBSA-N Synonym: --limonene,l-limonene,s---limonene,s-limonene,--4s-limonene,--s-limonene,s-p-mentha-1,8-diene,unii-47maj1y2ne,4s-limonene,p-mentha-1,8-diene, s-- PubChem CID: 439250 ChEBI: CHEBI:15383 IUPAC Name: (4S)-1-methyl-4-prop-1-en-2-ylcyclohexene SMILES: CC1=CCC(CC1)C(=C)C
PubChem CID | 439250 |
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CAS | 5989-54-8 |
Molecular Weight (g/mol) | 136.24 |
ChEBI | CHEBI:15383 |
MDL Number | MFCD00001558 |
SMILES | CC1=CCC(CC1)C(=C)C |
Synonym | --limonene,l-limonene,s---limonene,s-limonene,--4s-limonene,--s-limonene,s-p-mentha-1,8-diene,unii-47maj1y2ne,4s-limonene,p-mentha-1,8-diene, s-- |
IUPAC Name | (4S)-1-methyl-4-prop-1-en-2-ylcyclohexene |
InChI Key | XMGQYMWWDOXHJM-SNVBAGLBSA-N |
Molecular Formula | C10H16 |
Citral, 95%, mixture of cis and trans, Thermo Scientific Chemicals
CAS: 5392-40-5 Molecular Formula: C10H16O Molecular Weight (g/mol): 152.24 MDL Number: MFCD00006997 InChI Key: WTEVQBCEXWBHNA-JXMROGBWSA-N Synonym: citral,geranial,trans-citral,3,7-dimethylocta-2,6-dienal,geranialdehyde,e-citral,citral a,2e-3,7-dimethylocta-2,6-dienal,alpha-citral,lemsyn gb PubChem CID: 638011 ChEBI: CHEBI:16980 IUPAC Name: (2E)-3,7-dimethylocta-2,6-dienal SMILES: CC(C)=CCC\C(C)=C\C=O
PubChem CID | 638011 |
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CAS | 5392-40-5 |
Molecular Weight (g/mol) | 152.24 |
ChEBI | CHEBI:16980 |
MDL Number | MFCD00006997 |
SMILES | CC(C)=CCC\C(C)=C\C=O |
Synonym | citral,geranial,trans-citral,3,7-dimethylocta-2,6-dienal,geranialdehyde,e-citral,citral a,2e-3,7-dimethylocta-2,6-dienal,alpha-citral,lemsyn gb |
IUPAC Name | (2E)-3,7-dimethylocta-2,6-dienal |
InChI Key | WTEVQBCEXWBHNA-JXMROGBWSA-N |
Molecular Formula | C10H16O |
Pulegone, 92%, pract., Thermo Scientific Chemicals
CAS: 89-82-7 Molecular Formula: C10H16O Molecular Weight (g/mol): 152.24 MDL Number: MFCD00063000 InChI Key: NZGWDASTMWDZIW-QMMMGPOBSA-N Synonym: --pulegone,s---pulegone,pulegone,-,unii-hl7z89m60h,cyclohexanone, 5-methyl-2-1-methylethylidene-, s,s-p-menth-4 8-en-3-one,s-2-isopropylidene-5-methylcyclohexanone,5s-5-methyl-2-propan-2-ylidenecyclohexan-1-one PubChem CID: 638012 ChEBI: CHEBI:81226 IUPAC Name: (5S)-5-methyl-2-propan-2-ylidenecyclohexan-1-one SMILES: CC1CCC(=C(C)C)C(=O)C1
PubChem CID | 638012 |
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CAS | 89-82-7 |
Molecular Weight (g/mol) | 152.24 |
ChEBI | CHEBI:81226 |
MDL Number | MFCD00063000 |
SMILES | CC1CCC(=C(C)C)C(=O)C1 |
Synonym | --pulegone,s---pulegone,pulegone,-,unii-hl7z89m60h,cyclohexanone, 5-methyl-2-1-methylethylidene-, s,s-p-menth-4 8-en-3-one,s-2-isopropylidene-5-methylcyclohexanone,5s-5-methyl-2-propan-2-ylidenecyclohexan-1-one |
IUPAC Name | (5S)-5-methyl-2-propan-2-ylidenecyclohexan-1-one |
InChI Key | NZGWDASTMWDZIW-QMMMGPOBSA-N |
Molecular Formula | C10H16O |
Myrcene, 90%, tech., stabilized, Thermo Scientific Chemicals
CAS: 123-35-3 Molecular Formula: C10H16 Molecular Weight (g/mol): 136.24 InChI Key: UAHWPYUMFXYFJY-UHFFFAOYSA-N Synonym: myrcene,beta-myrcene,7-methyl-3-methyleneocta-1,6-diene,7-methyl-3-methylene-1,6-octadiene,1,6-octadiene, 7-methyl-3-methylene,beta-geraniolene,.beta.-myrcene,2-methyl-6-methylene-2,7-octadiene,3-methylene-7-methyl-1,6-octadiene,myrcene natural PubChem CID: 31253 ChEBI: CHEBI:17221 IUPAC Name: 7-methyl-3-methylideneocta-1,6-diene SMILES: CC(=CCCC(=C)C=C)C
PubChem CID | 31253 |
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CAS | 123-35-3 |
Molecular Weight (g/mol) | 136.24 |
ChEBI | CHEBI:17221 |
SMILES | CC(=CCCC(=C)C=C)C |
Synonym | myrcene,beta-myrcene,7-methyl-3-methyleneocta-1,6-diene,7-methyl-3-methylene-1,6-octadiene,1,6-octadiene, 7-methyl-3-methylene,beta-geraniolene,.beta.-myrcene,2-methyl-6-methylene-2,7-octadiene,3-methylene-7-methyl-1,6-octadiene,myrcene natural |
IUPAC Name | 7-methyl-3-methylideneocta-1,6-diene |
InChI Key | UAHWPYUMFXYFJY-UHFFFAOYSA-N |
Molecular Formula | C10H16 |
(+)-Limonene, 96%, unstabilized, Thermo Scientific Chemicals
CAS: 5989-27-5 Molecular Formula: C10H16 Molecular Weight (g/mol): 136.24 MDL Number: MFCD00062991 InChI Key: XMGQYMWWDOXHJM-JTQLQIEISA-N Synonym: d-limonene,+-limonene,r-+-limonene,+-4r-limonene,+-carvene,+-dipentene,citrene,+-p-mentha-1,8-diene,4r-limonene,d-+-limonene PubChem CID: 440917 ChEBI: CHEBI:15382 SMILES: CC(=C)[C@@H]1CCC(C)=CC1
PubChem CID | 440917 |
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CAS | 5989-27-5 |
Molecular Weight (g/mol) | 136.24 |
ChEBI | CHEBI:15382 |
MDL Number | MFCD00062991 |
SMILES | CC(=C)[C@@H]1CCC(C)=CC1 |
Synonym | d-limonene,+-limonene,r-+-limonene,+-4r-limonene,+-carvene,+-dipentene,citrene,+-p-mentha-1,8-diene,4r-limonene,d-+-limonene |
InChI Key | XMGQYMWWDOXHJM-JTQLQIEISA-N |
Molecular Formula | C10H16 |