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19-Norcholestane, (10.xi.)-
SpectraBase Compound ID IpX0yU9Step
InChI InChI=1S/C26H46/c1-18(2)8-7-9-19(3)24-14-15-25-23-13-12-20-10-5-6-11-21(20)22(23)16-17-26(24,25)4/h18-25H,5-17H2,1-4H3/t19-,20?,21+,22-,23-,24-,25+,26-/m1/s1
InChIKey DIEIYOCAHJJDBL-CGLPLZRSSA-N
Mol Weight 358.7 g/mol
Molecular Formula C26H46
Exact Mass 358.359951 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2uCAZZQAmxS
Name 19-Norcholestane, (10.xi.)-
CAS Registry Number 130855-71-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H46
InChI InChI=1S/C26H46/c1-18(2)8-7-9-19(3)24-14-15-25-23-13-12-20-10-5-6-11-21(20)22(23)16-17-26(24,25)4/h18-25H,5-17H2,1-4H3/t19-,20?,21+,22-,23-,24-,25+,26-/m1/s1
InChIKey DIEIYOCAHJJDBL-CGLPLZRSSA-N
Molecular Weight 358.654 g/mol
SMILES [C@@]12([C@]([C@@]3(CCC4[C@@]([C@]3(CC2)[H])(CCCC4)[H])[H])(CC[C@@]1([C@@](CCCC(C)C)(C)[H])[H])[H])C
SPLASH splash10-0pb9-0069000000-e4ab8cccdf1fd0274595
Source of Spectrum KC-1990-2203-0
Synonyms (17beta)-17-[(1R)-1,5-dimethylhexyl]estrane 19-Norcholestane (8R,9R,10S,13R,14S,17R)-13-methyl-17-[(2R)-6-methylheptan-2-yl]-1,2,3,4,5,6,7,8,9,10,11,12,14,15,16,17-hexadecahydrocyclopenta[a]phenanthrene
Wiley ID 1347555