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3.beta.-Acetoxy-24.epsilon.-ethyl-5.alpha.-cholestane
SpectraBase Compound ID 2FaegKMdiqZ
InChI InChI=1S/C31H54O2/c1-8-23(20(2)3)10-9-21(4)27-13-14-28-26-12-11-24-19-25(33-22(5)32)15-17-30(24,6)29(26)16-18-31(27,28)7/h20-21,23-29H,8-19H2,1-7H3/t21-,23?,24+,25+,26+,27-,28+,29+,30+,31-/m1/s1
InChIKey UOLJGJFAVGOXAH-NUPROOALSA-N
Mol Weight 458.8 g/mol
Molecular Formula C31H54O2
Exact Mass 458.412381 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LNx9YQ19wDJ
Name 3.beta.-Acetoxy-24.epsilon.-ethyl-5.alpha.-cholestane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H54O2
InChI InChI=1S/C31H54O2/c1-8-23(20(2)3)10-9-21(4)27-13-14-28-26-12-11-24-19-25(33-22(5)32)15-17-30(24,6)29(26)16-18-31(27,28)7/h20-21,23-29H,8-19H2,1-7H3/t21-,23?,24+,25+,26+,27-,28+,29+,30+,31-/m1/s1
InChIKey UOLJGJFAVGOXAH-NUPROOALSA-N
Molecular Weight 458.771 g/mol
SMILES [C@@]12([C@]([C@@]3(CC[C@@]4([C@@]([C@]3(CC2)[H])(CC[C@](OC(=O)C)(C4)[H])C)[H])[H])(CC[C@@]1([C@@](CCC(C(C)C)CC)(C)[H])[H])[H])C
SPLASH splash10-014i-0093100000-1f07e9c83dbdc48ec056
Source of Spectrum X4-17-422-0
Wiley ID 1585445