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5.ALPHA.-ANDROSTANE-7.ALPHA.,16.BETA.-DIOL(7.ALPHA.,16.BETA.-DI-ACETATE)
SpectraBase Compound ID J55ZcdvreOZ
InChI InChI=1S/C23H36O4/c1-14(24)26-17-12-19-21-18(8-10-22(19,3)13-17)23(4)9-6-5-7-16(23)11-20(21)27-15(2)25/h16-21H,5-13H2,1-4H3/t16-,17+,18+,19+,20-,21-,22-,23+/m1/s1
InChIKey MRTMHWVDLUUWPA-CJGRTHRNSA-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 FyKdNVzPCNu
Name 5.ALPHA.-ANDROSTANE-7.ALPHA.,16.BETA.-DIOL(7.ALPHA.,16.BETA.-DI-ACETATE)
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 376.261359635 u
Formula C23H36O4
InChI InChI=1S/C23H36O4/c1-14(24)26-17-12-19-21-18(8-10-22(19,3)13-17)23(4)9-6-5-7-16(23)11-20(21)27-15(2)25/h16-21H,5-13H2,1-4H3/t16-,17+,18+,19+,20-,21-,22-,23+/m1/s1
InChIKey MRTMHWVDLUUWPA-CJGRTHRNSA-N
Molecular Weight 376.537 g/mol
Nominal Mass 376 u
Number of Peaks 106
SMILES C1CC[C@@]2([C@]3(CC[C@@]4(C[C@](C[C@]4([C@@]3([C@@](C[C@]2(C1)[H])(OC(C)=O)[H])[H])[H])(OC(C)=O)[H])C)[H])C
SPLASH splash10-0a4m-3690000000-7cbc21edb1f5151ae281
Source File Reference LMCM-24082-999K
Source of Spectrum Dr. Makin, London Hospital Medical College, UK
Synonyms 16-(ACETYLOXY)ANDROSTAN-7-YL ACETATE (5R,7R,8S,9S,10S,13R,14S,16S)-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthrene-7,16-diyl diacetate
Wiley ID 4_2199