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(+-)-3-Methoxy-16-ketoestra-1,3,5(10),13(17)-tetraene

View entire compound with spectra: 1 MS (GC)

(+-)-3-Methoxy-16-ketoestra-1,3,5(10),13(17)-tetraene
SpectraBase Compound ID ElTVAyLYxT6
InChI InChI=1S/C18H20O2/c1-20-14-4-7-15-12(9-14)3-6-17-16(15)5-2-11-8-13(19)10-18(11)17/h4,7-9,16-18H,2-3,5-6,10H2,1H3/t16-,17-,18-/m1/s1
InChIKey YRYKZIRCQVYBMY-KZNAEPCWSA-N
Mol Weight 268.36 g/mol
Molecular Formula C18H20O2
Exact Mass 268.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6U19w0lpY0O
Name (+-)-3-Methoxy-16-ketoestra-1,3,5(10),13(17)-tetraene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20O2
InChI InChI=1S/C18H20O2/c1-20-14-4-7-15-12(9-14)3-6-17-16(15)5-2-11-8-13(19)10-18(11)17/h4,7-9,16-18H,2-3,5-6,10H2,1H3/t16-,17-,18-/m1/s1
InChIKey YRYKZIRCQVYBMY-KZNAEPCWSA-N
Molecular Weight 268.356 g/mol
SMILES C=12[C@]([C@@]3(CCc4c([C@]3(CC2)[H])ccc(OC)c4)[H])(CC(C1)=O)[H]
SPLASH splash10-014i-0690000000-bcc24a215a8ad3eb7556
Source of Spectrum U1-2010-652-11a
Wiley ID 1663370