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5b-Cholestan-3-one
SpectraBase Compound ID IYjBnqQwsSy
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/t19-,20-,22+,23-,24+,25+,26+,27-/m1/s1
InChIKey PESKGJQREUXSRR-JDIFZLMISA-N
Mol Weight 386.7 g/mol
Molecular Formula C27H46O
Exact Mass 386.354866 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID FUCHCrpeDP7
Name 5β-Cholestan-3-one
Source of Sample Steraloids Inc.
Catalog Number C5250-000
Lot Number L1812
Accessory DurasamplIR II
CAS Registry Number 601-53-6
Classification cholesterol type
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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/t19-,20-,22+,23-,24+,25+,26+,27-/m1/s1
InChIKey PESKGJQREUXSRR-JDIFZLMISA-N
Instrument Name Bio-Rad FTS
Melting Point 61.0 - 62.0 °C
Source of Spectrum Forensic Spectral Research
Synonyms 3-Oxocholestanone; Coprostanone; Coprostan-3-one
Technique ATR-Neat (DuraSamplIR II)