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3-oxoandrosta-1,4-dien-17-yl benzoate

View entire compound with spectra: 1 NMR, and 1 MS (GC)

3-oxoandrosta-1,4-dien-17-yl benzoate
SpectraBase Compound ID JvhKOElmKmn
InChI InChI=1S/C26H30O3/c1-25-14-12-19(27)16-18(25)8-9-20-21-10-11-23(26(21,2)15-13-22(20)25)29-24(28)17-6-4-3-5-7-17/h3-7,12,14,16,20-23H,8-11,13,15H2,1-2H3
InChIKey QYOIZDDZJSQWGQ-UHFFFAOYSA-N
Mol Weight 390.52 g/mol
Molecular Formula C26H30O3
Exact Mass 390.219495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8inEhTPqtEH
Name 1-Dehydrotestosterone benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H30O3
InChI InChI=1S/C26H30O3/c1-25-14-12-19(27)16-18(25)8-9-20-21-10-11-23(26(21,2)15-13-22(20)25)29-24(28)17-6-4-3-5-7-17/h3-7,12,14,16,20-23H,8-11,13,15H2,1-2H3
InChIKey QYOIZDDZJSQWGQ-UHFFFAOYSA-N
Ionization Type EI-B
Molecular Weight 390.523 g/mol
SMILES C12=CC(C=CC2(C2C(CC1)C1C(CC2)(C)C(OC(=O)c2ccccc2)CC1)C)=O
SPLASH splash10-05fr-0900000000-0e441856d5a8f5400048
Source of Spectrum SRH-2022-11423-0
Wiley ID 1833010