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3-(METHOXYIMINO)ESTR-4-EN-17.BETA.-YL 3-PHENYLPROPANOATE
SpectraBase Compound ID 6VoDIK4GYVS
InChI InChI=1S/C28H37NO3/c1-28-17-16-23-22-12-10-21(29-31-2)18-20(22)9-11-24(23)25(28)13-14-26(28)32-27(30)15-8-19-6-4-3-5-7-19/h3-7,18,22-26H,8-17H2,1-2H3/b29-21+/t22?,23?,24?,25?,26-,28-/m0/s1
InChIKey KXUWVGSNYIPSJB-FVDWJTDZSA-N
Mol Weight 435.6 g/mol
Molecular Formula C28H37NO3
Exact Mass 435.277344 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DjCwPDd6VuJ
Name 3-(METHOXYIMINO)ESTR-4-EN-17.BETA.-YL 3-PHENYLPROPANOATE
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 435.277344052 u
Formula C28H37NO3
InChI InChI=1S/C28H37NO3/c1-28-17-16-23-22-12-10-21(29-31-2)18-20(22)9-11-24(23)25(28)13-14-26(28)32-27(30)15-8-19-6-4-3-5-7-19/h3-7,18,22-26H,8-17H2,1-2H3/b29-21+/t22?,23?,24?,25?,26-,28-/m0/s1
InChIKey KXUWVGSNYIPSJB-FVDWJTDZSA-N
Molecular Weight 435.608 g/mol
Nominal Mass 435 u
Number of Peaks 34
SMILES C(CCc1ccccc1)(=O)O[C@]1(CCC2C3CCC4=C\C(CCC4C3CC[C@]12C)=N\OC)[H]
SPLASH splash10-0a4i-1190000000-cf7c87df8c686d266d0d
Source File Reference LMCM-62972-416V
Source of Spectrum Dr. Makin, London Hospital Medical College, UK
Synonyms ESTR-4-ENE-17.BETA.-OL-3-ONE(3-O-METHYLOXIME-17.BETA.-PHENYLPROPIONATE) (13S,17S,E)-3-(methoxyimino)-13-methyl-2,3,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl 3-phenylpropanoate
Wiley ID 4_1943