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ACETIC ACID 10,13-DIMETHYL-3-OXO-HEXADECAHYDRO-CYCLOPENTA[A]PHENANTHREN-17-YL ESTER
SpectraBase Compound ID 6cmOMaOdEBo
InChI InChI=1S/C21H32O3/c1-13(22)24-19-7-6-17-16-5-4-14-12-15(23)8-10-20(14,2)18(16)9-11-21(17,19)3/h14,16-19H,4-12H2,1-3H3/t14?,16?,17?,18?,19?,20-,21-/m0/s1
InChIKey ILCTUFVQFCIIDS-SPZVSZDXSA-N
Mol Weight 332.5 g/mol
Molecular Formula C21H32O3
Exact Mass 332.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JStTjhKoLSZ
Name 3-OXOANDROSTAN-17-YL ACETATE
CAS Registry Number 125638-46-2
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 332.235144887 u
Formula C21H32O3
InChI InChI=1S/C21H32O3/c1-13(22)24-19-7-6-17-16-5-4-14-12-15(23)8-10-20(14,2)18(16)9-11-21(17,19)3/h14,16-19H,4-12H2,1-3H3/t14?,16?,17?,18?,19?,20-,21-/m0/s1
InChIKey ILCTUFVQFCIIDS-SPZVSZDXSA-N
Molecular Weight 332.484 g/mol
Nominal Mass 332 u
Number of Peaks 189
SMILES C(C)(=O)OC1CCC2C3CCC4CC(CC[C@@]4(C3CC[C@]12C)C)=O
SPLASH splash10-0006-9740000000-165936dc750b5f47c1cf
Source File Reference LMCM-84668-641M
Source of Spectrum Prof. D. Henneberg, MPI f. Kohlenforschung, Muelheim a.d.R., Germany
Synonyms (2S,15S)-2,15-dimethyl-5-oxotetracyclo[8.7.0.0(2,7).0(11,15)]heptadecan-14-yl acetate 17-ACETOXY-ANDROSTAN-3-ONE
Wiley ID 8_32130