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Cholestane-3,6-diol
SpectraBase Compound ID A3gPvYg4ZFT
InChI InChI=1S/C27H48O2/c1-17(2)7-6-8-18(3)21-9-10-22-20-16-25(29)24-15-19(28)11-13-27(24,5)23(20)12-14-26(21,22)4/h17-25,28-29H,6-16H2,1-5H3
InChIKey PMWTYEQRXYIMND-UHFFFAOYSA-N
Mol Weight 404.7 g/mol
Molecular Formula C27H48O2
Exact Mass 404.365431 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F3zqmOLPEAU
Name 17-(1,5-DIMETHYLHEXYL)-10,13-DIMETHYLHEXADECAHYDRO-CYCLOPENTA[a]PHENANTHRENE-3,5,6-TRIOL
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C27H48O3
InChI InChI=1S/C27H48O2/c1-17(2)7-6-8-18(3)21-9-10-22-20-16-25(29)24-15-19(28)11-13-27(24,5)23(20)12-14-26(21,22)4/h17-25,28-29H,6-16H2,1-5H3
InChIKey PMWTYEQRXYIMND-UHFFFAOYSA-N
Molecular Weight 404.3642
SMILES OC1CCC2(C3CCC4(C(CCC4C3CC(O)C2C1)C(CCCC(C)C)C)C)C
SPLASH splash10-052f-9621000000-131c671a60aabd2e3117
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany