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3-(Isopropylidene)-4-nor-7-methylcholestan-7-ol

View entire compound with spectra: 1 MS (GC)

3-(Isopropylidene)-4-nor-7-methylcholestan-7-ol
SpectraBase Compound ID 7Q1BUU5f9ES
InChI InChI=1S/C30H52O/c1-19(2)10-9-11-21(5)23-12-13-24-27-25(15-17-28(23,24)6)29(7)16-14-22(20(3)4)26(29)18-30(27,8)31/h19,21,23-27,31H,9-18H2,1-8H3/t21-,23-,24+,25+,26?,27+,28-,29-,30-/m1/s1
InChIKey NPVLQPVQQYEZEI-VGXIAENWSA-N
Mol Weight 428.7 g/mol
Molecular Formula C30H52O
Exact Mass 428.401816 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F0ZiyFg0FLI
Name 3-(Isopropylidene)-4-nor-7-methylcholestan-7-ol
Alternate Name(s) (1R,3aS,3bS,8aR,8bS,10aR)-1-[(1R)-1,5-dimethylhexyl]-4,8a,10a-trimethyl-6-(1-methylethylidene)hexadecahydrodicyclopenta[a,f]naphthalen-4-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H52O
InChI InChI=1S/C30H52O/c1-19(2)10-9-11-21(5)23-12-13-24-27-25(15-17-28(23,24)6)29(7)16-14-22(20(3)4)26(29)18-30(27,8)31/h19,21,23-27,31H,9-18H2,1-8H3/t21-,23-,24+,25+,26?,27+,28-,29-,30-/m1/s1
InChIKey NPVLQPVQQYEZEI-VGXIAENWSA-N
Molecular Weight 428.745 g/mol
SMILES O[C@]1([C@]2([C@@]3(CC[C@@]([C@]3(CC[C@@]2([C@@]2(C(C(=C(C)C)CC2)C1)C)[H])C)([C@@](CCCC(C)C)(C)[H])[H])[H])[H])C
SPLASH splash10-03di-2305900000-22372681731d5baf964c
Source of Spectrum J-61-866-21
Wiley ID 1381044