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Cholestan-7-one, (5.alpha.)-
SpectraBase Compound ID BjrqC5cdIHe
InChI InChI=1S/C27H46O/c1-18(2)9-8-10-19(3)21-12-13-22-25-23(14-16-27(21,22)5)26(4)15-7-6-11-20(26)17-24(25)28/h18-23,25H,6-17H2,1-5H3
InChIKey SFRHQVIYMXPVMD-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 6MJMKyiAXTZ
Name 5-alpha(H)-CHOLESTAN-7-ONE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C27H46O
InChI InChI=1S/C27H46O/c1-18(2)9-8-10-19(3)21-12-13-22-25-23(14-16-27(21,22)5)26(4)15-7-6-11-20(26)17-24(25)28/h18-23,25H,6-17H2,1-5H3
InChIKey SFRHQVIYMXPVMD-UHFFFAOYSA-N
Instrument Name VG70
Molecular Weight 388.37
SMILES C12(CC(=O)C3C4CCC(C(CCCC(C)C)C)C4(C)CCC3C2(CCCC1)C)[HH]
SPLASH splash10-056a-7952000000-7e14e77adb07664ae2ae
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany