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17.BETA.-ACETOXY-3,3-ETHYLENDIOXY-5.BETA.-ANDROSTAN
SpectraBase Compound ID CMDi32n0H3p
InChI InChI=1S/C23H36O4/c1-15(24)27-20-7-6-18-17-5-4-16-14-23(25-12-13-26-23)11-10-21(16,2)19(17)8-9-22(18,20)3/h16-20H,4-14H2,1-3H3/t16-,17+,18+,19+,20+,21+,22+/m1/s1
InChIKey GSSIBIORSPCRIO-BHXFFAOXSA-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 4fcln1bxaW3
Name 17.BETA.-ACETOXY-3,3-ETHYLENDIOXY-5.BETA.-ANDROSTAN
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 376.261359635 u
Formula C23H36O4
InChI InChI=1S/C23H36O4/c1-15(24)27-20-7-6-18-17-5-4-16-14-23(25-12-13-26-23)11-10-21(16,2)19(17)8-9-22(18,20)3/h16-20H,4-14H2,1-3H3/t16-,17+,18+,19+,20+,21+,22+/m1/s1
InChIKey GSSIBIORSPCRIO-BHXFFAOXSA-N
Molecular Weight 376.537 g/mol
Nominal Mass 376 u
Number of Peaks 24
SMILES C12(CC[C@@]3([C@]4(CC[C@@]5([C@](CC[C@]5([C@@]4(CC[C@@]3(C2)[H])[H])[H])(OC(=O)C)[H])C)[H])C)OCCO1
SPLASH splash10-002b-9402000000-b443fcf9685612dc9478
Source File Reference LMCM-48642-940D
Source of Spectrum Prof. Spiteller, University Bayreuth, Germany
Synonyms (5R,8R,9S,10S,13S,14S,17S)-10,13-dimethylhexadecahydrospiro[cyclopenta[a]phenanthrene-3,2'-[1,3]dioxolane]-17-yl acetate
Wiley ID 4_478