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Cholestan-7-one, (5.alpha.)-

View entire compound with spectra: 1 NMR, and 9 MS (GC)

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

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4Bun9ble42F
Name 7-Cholestanone
CAS Registry Number 567-71-5
Comments reassigned
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 Varian XL-100
Literature Reference H. Eggert, C. Djerassi, J. Org. Chem. 38, 3788 (1973).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3