| SpectraBase Compound ID | JNBqeBCIkQz |
|---|---|
| InChI | InChI=1S/C35H54O2/c1-23(2)10-9-11-24(3)29-16-17-30-27-15-14-26-21-33(37)28(32(36)20-25-12-7-6-8-13-25)22-35(26,5)31(27)18-19-34(29,30)4/h6-8,12-13,23-24,26-32,36H,9-11,14-22H2,1-5H3 |
| InChIKey | QYHQJQMYWUUPGK-UHFFFAOYSA-N |
| Mol Weight | 506.8 g/mol |
| Molecular Formula | C35H54O2 |
| Exact Mass | 506.412381 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | CWvKbzyNDqE |
|---|---|
| Name | 2-(1-Hydroxy-2-phenylethyl)cholestan-3-one |
| Alternate Name(s) | 10,13-dimethyl-17-(6-methylheptan-2-yl)-2-(1-oxidanyl-2-phenyl-ethyl)-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one 17-(1,5-dimethylhexyl)-2-(1-hydroxy-2-phenyl-ethyl)-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one 17-(1,5-Dimethylhexyl)-2-(1-hydroxy-2-phenylethyl)-10,13-dimethylhexadecahydrocyclopenta[a]phenanthren-3-one 2-(1-hydroxy-2-phenylethyl)-10,13-dimethyl-17-(6-methylheptan-2-yl)-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C35H54O2 |
| InChI | InChI=1S/C35H54O2/c1-23(2)10-9-11-24(3)29-16-17-30-27-15-14-26-21-33(37)28(32(36)20-25-12-7-6-8-13-25)22-35(26,5)31(27)18-19-34(29,30)4/h6-8,12-13,23-24,26-32,36H,9-11,14-22H2,1-5H3 |
| InChIKey | QYHQJQMYWUUPGK-UHFFFAOYSA-N |
| Molecular Weight | 506.815 g/mol |
| SMILES | OC(C1C(CC2CCC3C4C(CCC3C2(C1)C)(C(CC4)C(CCCC(C)C)C)C)=O)Cc1ccccc1 |
| SPLASH | splash10-001l-9531100000-8bda1f9e1822ed0acce6 |
| Wiley ID | 1475068 |