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14-.beta.(D)-17-.beta.(H)-cholestane
SpectraBase Compound ID 1dt6l3J0JeT
InChI InChI=1S/C27H48/c1-19(2)9-8-10-20(3)23-14-15-24-22-13-12-21-11-6-7-17-26(21,4)25(22)16-18-27(23,24)5/h19-25H,6-18H2,1-5H3/t20-,21?,22+,23-,24-,25+,26+,27-/m1/s1/i24D
InChIKey XIIAYQZJNBULGD-NMEDJJJHSA-N
Mol Weight 373.7 g/mol
Molecular Formula C27H472D
Exact Mass 373.381878 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hebrhp1FHib
Name 14-.beta.(D)-17-.beta.(H)-cholestane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H47D
InChI InChI=1S/C27H48/c1-19(2)9-8-10-20(3)23-14-15-24-22-13-12-21-11-6-7-17-26(21,4)25(22)16-18-27(23,24)5/h19-25H,6-18H2,1-5H3/t20-,21?,22+,23-,24-,25+,26+,27-/m1/s1/i24D
InChIKey XIIAYQZJNBULGD-NMEDJJJHSA-N
Molecular Weight 373.687 g/mol
SMILES [C@@]12([C@@]([C@@]3(CCC4[C@]([C@]3(CC2)[H])(C)CCCC4)[H])(CC[C@@]1([C@@](CCCC(C)C)(C)[H])[H])[2D])C
SPLASH splash10-01b9-9763000000-ac06697457d06028c0f3
Source of Spectrum SD-1992-0-0
Synonyms 14-.beta.(D)-17-.beta.(H)-choles
Wiley ID 1355954