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(4.alpha.,5.alpha.)-4-methyl-17-oxoandrostane-4-carboxylic acid methyl ester
SpectraBase Compound ID 75BW2D3dNcb
InChI InChI=1S/C22H34O3/c1-20-11-5-12-22(3,19(24)25-4)17(20)8-6-14-15-7-9-18(23)21(15,2)13-10-16(14)20/h14-17H,5-13H2,1-4H3/t14-,15-,16-,17?,20+,21-,22?/m0/s1
InChIKey RJAFLYXVYLHHPC-WNPRSRMLSA-N
Mol Weight 346.5 g/mol
Molecular Formula C22H34O3
Exact Mass 346.250795 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9HC9TC3Uel0
Name (4.alpha.,5.alpha.)-4-methyl-17-oxoandrostane-4-carboxylic acid methyl ester
CAS Registry Number 23527-16-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H34O3
InChI InChI=1S/C22H34O3/c1-20-11-5-12-22(3,19(24)25-4)17(20)8-6-14-15-7-9-18(23)21(15,2)13-10-16(14)20/h14-17H,5-13H2,1-4H3/t14-,15-,16-,17?,20+,21-,22?/m0/s1
InChIKey RJAFLYXVYLHHPC-WNPRSRMLSA-N
Molecular Weight 346.511 g/mol
SMILES [C@@]12(C(C(C(=O)OC)(C)CCC2)CC[C@]2([C@@]3(CCC([C@]3(CC[C@]12[H])C)=O)[H])[H])C
SPLASH splash10-002v-4239000000-12d1c67904eafc1159ef
Source of Spectrum J-55-2373-16
Synonyms (4.alpha.,5.alpha.)-4-methyl-17-oxoandeostane-4-carboxylic acid methyl ester Methyl 4-methyl-17-oxoandrostane-4-carboxylate
Wiley ID 1339638