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5.alpha.-Cholestan-19-ol, 2.alpha.-methoxy-
SpectraBase Compound ID Eoz27ZJlES2
InChI InChI=1S/C28H50O2/c1-19(2)7-6-8-20(3)24-13-14-25-23-12-10-21-9-11-22(30-5)17-28(21,18-29)26(23)15-16-27(24,25)4/h19-26,29H,6-18H2,1-5H3/t20-,21-,22+,23+,24-,25+,26+,27-,28-/m1/s1
InChIKey CPTDGNKZZHLPIZ-NRYANEGPSA-N
Mol Weight 418.7 g/mol
Molecular Formula C28H50O2
Exact Mass 418.381081 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KTh8gofXcEc
Name 5.alpha.-Cholestan-19-ol, 2.alpha.-methoxy-
Alternate Name(s) (2alpha,5alpha)-2-methoxycholestan-19-ol 2.alpha.-methoxy-19-hydroxymethyl-5.alpha.-cholestane
CAS Registry Number 28809-60-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H50O2
InChI InChI=1S/C28H50O2/c1-19(2)7-6-8-20(3)24-13-14-25-23-12-10-21-9-11-22(30-5)17-28(21,18-29)26(23)15-16-27(24,25)4/h19-26,29H,6-18H2,1-5H3/t20-,21-,22+,23+,24-,25+,26+,27-,28-/m1/s1
InChIKey CPTDGNKZZHLPIZ-NRYANEGPSA-N
Molecular Weight 418.706 g/mol
SMILES OC[C@]12[C@]3(CC[C@]4([C@]([C@@]3(CC[C@]2(CC[C@@](C1)(OC)[H])[H])[H])(CC[C@@]4([C@@](CCCC(C)C)(C)[H])[H])[H])C)[H]
SPLASH splash10-052r-0009100000-0f32fbce048437d0f020
Source of Spectrum O-4-374-1
Wiley ID 1377482