Cas no 99305-20-1 (9-Oxo-1(10),11(13)-eremophiladien-12-al)
99305-20-1 structure
Product Name:9-Oxo-1(10),11(13)-eremophiladien-12-al
CAS No:99305-20-1
MF:C15H20O2
MW:232.318104743958
CID:2023956
Update Time:2025-04-21
9-Oxo-1(10),11(13)-eremophiladien-12-al Chemical and Physical Properties
Names and Identifiers
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- 9-Oxo-1(10),11(13)-eremophiladien-12-al
- 9-oxoeremophila-10,11(13)-dien-12-al
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- Inchi： 1S/C15H20O2/c1-10(9-16)12-7-14(17)13-6-4-5-11(2)15(13,3)8-12/h6,9,11-12H,1,4-5,7-8H2,2-3H3
- InChI Key： FMPPGODTDPKBOG-UHFFFAOYSA-N
- SMILES： CC1C2(C(C(CC(C(C=O)=C)C2)=O)=CCC1)C
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 17
- XLogP3: 2.71
9-Oxo-1(10),11(13)-eremophiladien-12-al Related Literature
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Felix Witte,Philipp Rietsch,Nithiya Nirmalananthan-Budau,Florian Weigert,Jan P. G?tze,Ute Resch-Genger,Siegfried Eigler,Beate Paulus Phys. Chem. Chem. Phys., 2021,23, 17521-17529
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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Govind Reddy Mol. Syst. Des. Eng., 2021,6, 779-789
Related Categories
- Solvents and Organic Chemicals Organic Compounds Lipids and lipid-like molecules Prenol lipids Eremophilane, 8,9-secoeremophilane and furoeremophilane sesquiterpenoids
- Solvents and Organic Chemicals Organic Compounds Lipids and lipid-like molecules Prenol lipids Sesquiterpenoids Eremophilane, 8,9-secoeremophilane and furoeremophilane sesquiterpenoids
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