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19-HYDROXY-4,4-DIMETHYL-3-OXOANDROSTAN-17-YL ACETATE
SpectraBase Compound ID EPkjWHMPg4x
InChI InChI=1S/C23H36O4/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/h15-18,20,24H,5-13H2,1-4H3/t15?,16?,17?,18?,20?,22-,23-/m0/s1
InChIKey LRSJYBYJMSDMBT-XQBCELBGSA-N
Mol Weight 376.5 g/mol
Molecular Formula C23H36O4
Exact Mass 376.26136 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DAHKzs2qtKJ
Name 19-HYDROXY-4,4-DIMETHYL-3-OXOANDROSTAN-17-YL ACETATE
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 376.261359635 u
Formula C23H36O4
InChI InChI=1S/C23H36O4/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/h15-18,20,24H,5-13H2,1-4H3/t15?,16?,17?,18?,20?,22-,23-/m0/s1
InChIKey LRSJYBYJMSDMBT-XQBCELBGSA-N
Molecular Weight 376.537 g/mol
Nominal Mass 376 u
Number of Peaks 233
SMILES OC[C@@]12C3CC[C@@]4(C(CCC4C3CCC1C(C(CC2)=O)(C)C)OC(C)=O)C
SPLASH splash10-0006-9521000000-980a92c5f6d5b3121e69
Source File Reference LMCM-55689-208U
Source of Spectrum Prof. J. Seibl; ETH Zurich, Switzerland
Synonyms (2S,15S)-2-(hydroxymethyl)-6,6,15-trimethyl-5-oxotetracyclo[8.7.0.0(2,7).0(11,15)]heptadecan-14-yl acetate
Wiley ID 8_12121