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24-Norcholane, 23-[2-methyl-1-(1-methylethyl)cyclopropyl]-, (5.alpha.)-
SpectraBase Compound ID LY69FmcdJG8
InChI InChI=1S/C30H52/c1-20(2)30(19-22(30)4)18-14-21(3)25-12-13-26-24-11-10-23-9-7-8-16-28(23,5)27(24)15-17-29(25,26)6/h20-27H,7-19H2,1-6H3
InChIKey MLIRMQLHYQMJGR-UHFFFAOYSA-N
Mol Weight 412.7 g/mol
Molecular Formula C30H52
Exact Mass 412.406902 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2ozd0xR2Ltt
Name 24-Norcholane, 23-[2-methyl-1-(1-methylethyl)cyclopropyl]-, (5.alpha.)-
CAS Registry Number 53755-13-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H52
InChI InChI=1S/C30H52/c1-20(2)30(19-22(30)4)18-14-21(3)25-12-13-26-24-11-10-23-9-7-8-16-28(23,5)27(24)15-17-29(25,26)6/h20-27H,7-19H2,1-6H3
InChIKey MLIRMQLHYQMJGR-UHFFFAOYSA-N
Molecular Weight 412.746 g/mol
SMILES C(CC(C)C1C2(C)C(C3C(CC2)C2(C)C(CC3)CCCC2)CC1)C1(C(C)C)C(C)C1
SPLASH splash10-0aos-9631000000-5ff0fa5504c2d1242d03
Source of Spectrum SD-1981-0-0
Synonyms 10,13-dimethyl-17-[4-(2-methyl-1-propan-2-yl-cyclopropyl)butan-2-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene 17-[3-(1-isopropyl-2-methyl-cyclopropyl)-1-methyl-propyl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene
Wiley ID 1374890