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17.BETA.-(ACETYLOXY)-19-HYDROXY-4,4-DIMETHYL-ANDROST-5-EN-3-ONE
SpectraBase Compound ID Dkwh7cg9pkI
InChI InChI=1S/C23H34O4/c1-14(25)27-20-8-6-16-15-5-7-18-21(2,3)19(26)10-12-23(18,13-24)17(15)9-11-22(16,20)4/h7,15-17,20,24H,5-6,8-13H2,1-4H3/t15-,16-,17-,20-,22-,23-/m0/s1
InChIKey ZMIXPOKOXQFFKV-WFHIMZCYSA-N
Mol Weight 374.5 g/mol
Molecular Formula C23H34O4
Exact Mass 374.24571 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ez4ldIzxLSc
Name 17.BETA.-(ACETYLOXY)-19-HYDROXY-4,4-DIMETHYL-ANDROST-5-EN-3-ONE
CAS Registry Number 53225-09-5
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 374.245709571 u
Formula C23H34O4
InChI InChI=1S/C23H34O4/c1-14(25)27-20-8-6-16-15-5-7-18-21(2,3)19(26)10-12-23(18,13-24)17(15)9-11-22(16,20)4/h7,15-17,20,24H,5-6,8-13H2,1-4H3/t15-,16-,17-,20-,22-,23-/m0/s1
InChIKey ZMIXPOKOXQFFKV-WFHIMZCYSA-N
Molecular Weight 374.521 g/mol
Nominal Mass 374 u
Number of Peaks 301
SMILES OC[C@@]12[C@]3(CC[C@@]4([C@](CC[C@]4([C@@]3(CC=C1C(C(CC2)=O)(C)C)[H])[H])(OC(=O)C)[H])C)[H]
SPLASH splash10-0006-5976000000-a8f18fc6ec931ab56a71
Source File Reference LMCM-42069-649L
Source of Spectrum Prof. J. Seibl; ETH Zurich, Switzerland
Synonyms 19-HYDROXY-4,4-DIMETHYL-3-OXOANDROST-5-EN-17-YL ACETATE (1S,2S,10R,11S,14S,15S)-2-(hydroxymethyl)-6,6,15-trimethyl-5-oxotetracyclo[8.7.0.0(2,7).0(11,15)]heptadec-7-en-14-yl acetate
Wiley ID 8_19491