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3-METHOXY-4,4-DIMETHYL-19-OXOANDROSTAN-17-YL ACETATE
SpectraBase Compound ID l3KQyyYf76
InChI InChI=1S/C24H38O4/c1-15(26)28-21-9-7-17-16-6-8-19-22(2,3)20(27-5)11-13-24(19,14-25)18(16)10-12-23(17,21)4/h14,16-21H,6-13H2,1-5H3/t16?,17?,18?,19?,20?,21?,23-,24-/m0/s1
InChIKey NLMSZFFYNLIITR-BSMVALDLSA-N
Mol Weight 390.6 g/mol
Molecular Formula C24H38O4
Exact Mass 390.27701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8QA6NatPAIq
Name 3-METHOXY-4,4-DIMETHYL-19-OXOANDROSTAN-17-YL ACETATE
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 390.277009700 u
Formula C24H38O4
InChI InChI=1S/C24H38O4/c1-15(26)28-21-9-7-17-16-6-8-19-22(2,3)20(27-5)11-13-24(19,14-25)18(16)10-12-23(17,21)4/h14,16-21H,6-13H2,1-5H3/t16?,17?,18?,19?,20?,21?,23-,24-/m0/s1
InChIKey NLMSZFFYNLIITR-BSMVALDLSA-N
Molecular Weight 390.564 g/mol
Nominal Mass 390 u
Number of Peaks 315
SMILES C(C)(=O)OC1CCC2C3CCC4C(C(CC[C@@]4(C3CC[C@]12C)C=O)OC)(C)C
SPLASH splash10-0006-7955000000-07d5395316e8af3f6184
Source File Reference LMCM-75504-728L
Source of Spectrum Prof. J. Seibl; ETH Zurich, Switzerland
Synonyms (2S,15S)-2-formyl-5-methoxy-6,6,15-trimethyltetracyclo[8.7.0.0(2,7).0(11,15)]heptadecan-14-yl acetate
Wiley ID 8_11354