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Cholest-5-en-3-ol, 19-methoxy-, acetate, (3.beta.)-
SpectraBase Compound ID JZsPItUhD7Y
InChI InChI=1S/C30H50O3/c1-20(2)8-7-9-21(3)26-12-13-27-25-11-10-23-18-24(33-22(4)31)14-17-30(23,19-32-6)28(25)15-16-29(26,27)5/h10,20-21,24-28H,7-9,11-19H2,1-6H3/t21-,24+,25+,26-,27+,28+,29-,30-/m1/s1
InChIKey VATTZKXEVIXTCP-WTTFBDAUSA-N
Mol Weight 458.7 g/mol
Molecular Formula C30H50O3
Exact Mass 458.375995 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Eo8ZSDrDptd
Name Cholest-5-en-3-ol, 19-methoxy-, acetate, (3.beta.)-
Alternate Name(s) (3beta)-19-methoxycholest-5-en-3-yl acetate C19-methoxymethyl cholesterol acetate Cholest-5-en-3.beta.-ol, 19-methoxy-, acetate
CAS Registry Number 1108-65-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H50O3
InChI InChI=1S/C30H50O3/c1-20(2)8-7-9-21(3)26-12-13-27-25-11-10-23-18-24(33-22(4)31)14-17-30(23,19-32-6)28(25)15-16-29(26,27)5/h10,20-21,24-28H,7-9,11-19H2,1-6H3/t21-,24+,25+,26-,27+,28+,29-,30-/m1/s1
InChIKey VATTZKXEVIXTCP-WTTFBDAUSA-N
Molecular Weight 458.727 g/mol
SMILES [C@@]12([C@]([C@@]3(CC=C4[C@@]([C@]3(CC2)[H])(CC[C@](OC(=O)C)(C4)[H])COC)[H])(CC[C@@]1([C@@](CCCC(C)C)(C)[H])[H])[H])C
SPLASH splash10-0udi-0009000000-acb2c2fcaf33218be084
Source of Spectrum T-68-5635-0
Wiley ID 1390023