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5a-Cholestan-3-one
SpectraBase Compound ID AVjxXUyi4wV
InChI InChI=1S/C27H46O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h18-20,22-25H,6-17H2,1-5H3
InChIKey PESKGJQREUXSRR-UHFFFAOYSA-N
Mol Weight 386.7 g/mol
Molecular Formula C27H46O
Exact Mass 386.354866 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IyFf23tp7fd
Name 17-(1,5-DIMETHYLHEXYL)-10,13-DIMETHYLHEXADECAHYDRO-CYCLOPENTA[a]PHENANTHREN-3-ONE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C27H46O
InChI InChI=1S/C27H46O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h18-20,22-25H,6-17H2,1-5H3
InChIKey PESKGJQREUXSRR-UHFFFAOYSA-N
Molecular Weight 386.3537
SMILES C1(=O)CC2C(C)(C3CCC4(C)C(C(C)CCCC(C)C)CCC4C3CC2)CC1
SPLASH splash10-001i-9751000000-05b29af35b9c16fab009
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany