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Estra-1,3,5(10)-trien-17-one, 3,7-dihydroxy-, O-methyloxime, (7.alpha.)-
SpectraBase Compound ID Ej84wVzkz8Z
InChI InChI=1S/C19H25NO3/c1-19-8-7-14-13-4-3-12(21)9-11(13)10-16(22)18(14)15(19)5-6-17(19)20-23-2/h3-4,9,14-16,18,21-22H,5-8,10H2,1-2H3/b20-17+
InChIKey NOJSHJHVXIOMDI-LVZFUZTISA-N
Mol Weight 315.41 g/mol
Molecular Formula C19H25NO3
Exact Mass 315.183444 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3QGstKBRyYJ
Name Estra-1,3,5(10)-trien-17-one, 3,7-dihydroxy-, O-methyloxime, (7.alpha.)-
CAS Registry Number 74299-31-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H25NO3
InChI InChI=1S/C19H25NO3/c1-19-8-7-14-13-4-3-12(21)9-11(13)10-16(22)18(14)15(19)5-6-17(19)20-23-2/h3-4,9,14-16,18,21-22H,5-8,10H2,1-2H3/b20-17+
InChIKey NOJSHJHVXIOMDI-LVZFUZTISA-N
Molecular Weight 315.413 g/mol
SMILES OC1Cc2c(ccc(c2)O)C2CCC3(\C(CCC3C12)=N/OC)C
SPLASH splash10-0006-9550000000-bfe5f695e9099fd0e1df
Source of Spectrum W5-28358-0-0
Synonyms 3,7-Dihydroxyestra-1(10),2,4-trien-17-one o-methyloxime (17E)-13-methyl-17-methyloximino-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,7-diol (17E)-17-methoxyimino-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,7-diol
Wiley ID 1316090