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2-(17-Hydroxy-10,13-dimethylhexadecahydrocyclopenta[a]phenanthren-17-yl)-2-methylpropionic acid, ethyl ester
SpectraBase Compound ID ZjYp4hG3ro
InChI InChI=1S/C25H42O3/c1-6-28-21(26)22(2,3)25(27)16-13-20-18-11-10-17-9-7-8-14-23(17,4)19(18)12-15-24(20,25)5/h17-20,27H,6-16H2,1-5H3
InChIKey IVMMKQAUEOKNPU-UHFFFAOYSA-N
Mol Weight 390.6 g/mol
Molecular Formula C25H42O3
Exact Mass 390.313395 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1oqODiuvmGs
Name 2-(17-HYDROXY-10,13-DIMETHYL-HEXADECAHYDRO-CYCLOPENTA[A]PHENANTHREN-17-YL)-2-METHYL-PROPIONIC ACID ETHYL ESTER
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Exact Mass 390.313395209 u
Formula C25H42O3
InChI InChI=1S/C25H42O3/c1-6-28-21(26)22(2,3)25(27)16-13-20-18-11-10-17-9-7-8-14-23(17,4)19(18)12-15-24(20,25)5/h17-20,27H,6-16H2,1-5H3
InChIKey IVMMKQAUEOKNPU-UHFFFAOYSA-N
Molecular Weight 390.608 g/mol
Nominal Mass 390 u
Number of Peaks 191
SMILES OC1(CCC2C1(CCC1C2CCC2CCCCC12C)C)C(C)(C)C(=O)OCC
SPLASH splash10-0563-7960000000-1aabdf932ae92dfddc6f
Source File Reference LMCM-75810-466Q
Source of Spectrum Prof. J. Seibl; ETH Zurich, Switzerland
Synonyms ethyl 2-{14-hydroxy-2,15-dimethyltetracyclo[8.7.0.0(2,7).0(11,15)]heptadecan-14-yl}-2-methylpropanoate
Wiley ID 8_19633