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7,17-Dioxoandrost-5-en-3.beta.-yl acetate - 7-{O-[3'-(methoxycarbonyl)propyl]}oxime
SpectraBase Compound ID 4kTCnn2h2oD
InChI InChI=1S/C26H37NO6/c1-16(28)33-18-9-11-25(2)17(14-18)15-21(27-32-13-5-6-23(30)31-4)24-19-7-8-22(29)26(19,3)12-10-20(24)25/h15,18-20,24H,5-14H2,1-4H3/b27-21-/t18-,19-,20-,24-,25-,26-/m0/s1
InChIKey JOBAXQVYDAIGBP-RMKIJQINSA-N
Mol Weight 459.6 g/mol
Molecular Formula C26H37NO6
Exact Mass 459.262088 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HkBHmUDnP0j
Name 7,17-Dioxoandrost-5-en-3.beta.-yl acetate - 7-{O-[3'-(methoxycarbonyl)propyl]}oxime
Alternate Name(s) Methyl 4-({[(3beta)-3-(acetyloxy)-17-oxoandrost-5-en-7-ylidene]amino}oxy)butanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H37NO6
InChI InChI=1S/C26H37NO6/c1-16(28)33-18-9-11-25(2)17(14-18)15-21(27-32-13-5-6-23(30)31-4)24-19-7-8-22(29)26(19,3)12-10-20(24)25/h15,18-20,24H,5-14H2,1-4H3/b27-21-/t18-,19-,20-,24-,25-,26-/m0/s1
InChIKey JOBAXQVYDAIGBP-RMKIJQINSA-N
Molecular Weight 459.583 g/mol
SMILES [C@]12(C(=C\C([C@]3([C@@]4(CCC([C@]4(CC[C@]23[H])C)=O)[H])[H])=N\OCCCC(=O)OC)C[C@@](OC(=O)C)(CC1)[H])C
SPLASH splash10-0udi-0966500000-8e02a82872bffd66bb0c
Source of Spectrum G-62-465-11
Wiley ID 749271