1-Cyclohexeno[2,3-b]cholestan-1'-one

SpectraBase Compound ID	2SuVOuc7seO
InChI	InChI=1S/C31H50O/c1-20(2)9-8-10-21(3)26-15-16-27-25-14-13-23-19-22-11-6-7-12-24(22)29(32)31(23,5)28(25)17-18-30(26,27)4/h12,20-23,25-28H,6-11,13-19H2,1-5H3
InChIKey	CFNNZQCUBAFDRT-UHFFFAOYSA-N Google Search
Mol Weight	438.7 g/mol
Molecular Formula	C31H50O
Exact Mass	438.386166 g/mol

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SpectraBase Spectrum ID	JPTMqOC4bMk
Name	1-(1,5-DIMETHYLHEXYL)-11A,13A-DIMETHYL-1,2,3,3A,3B,4,5,5A,6,6A,7,8,9,11A,11B,12,13,13A-OCTADECAHYDRO-11H-INDENO[5,4-A]ANTHRACEN-11-ONE
Copyright	Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass	438.386166229 u
Formula	C31H50O
InChI	InChI=1S/C31H50O/c1-20(2)9-8-10-21(3)26-15-16-27-25-14-13-23-19-22-11-6-7-12-24(22)29(32)31(23,5)28(25)17-18-30(26,27)4/h12,20-23,25-28H,6-11,13-19H2,1-5H3
InChIKey	CFNNZQCUBAFDRT-UHFFFAOYSA-N
Molecular Weight	438.740 g/mol
Nominal Mass	438 u
Number of Peaks	349
SMILES	C12C(CCC3CC4CCCC=C4C(C13C)=O)C1CCC(C1(CC2)C)C(CCCC(C)C)C
SPLASH	splash10-03di-3910100000-65a34ffe4d81a59de782
Source File Reference	LMCM-90654-273N
Synonyms	1,5-dimethyl-6-(6-methylheptan-2-yl)pentacyclo[11.8.0.0(2,10).0(5,9).0(15,20)]henicos-19-en-21-one
Wiley ID	8_8416