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ESTRA-1,3,5(10)-TRIEN-17-OL, 3-METHOXY-, ACETATE, (17beta)-(.+-.)-

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ESTRA-1,3,5(10)-TRIEN-17-OL, 3-METHOXY-, ACETATE, (17beta)-(.+-.)-
SpectraBase Compound ID IGSGRjGKSPQ
InChI InChI=1S/C19H26O.C2H4O2/c1-19-10-3-4-18(19)17-7-5-13-12-14(20-2)6-8-15(13)16(17)9-11-19;1-2(3)4/h6,8,12,16-18H,3-5,7,9-11H2,1-2H3;1H3,(H,3,4)
InChIKey VOWAZZOBJHTJFU-UHFFFAOYSA-N
Mol Weight 330.47 g/mol
Molecular Formula C21H30O3
Exact Mass 330.219495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FZACBB0eb5N
Name
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H27O3D
InChI InChI=1S/C19H26O.C2H4O2/c1-19-10-3-4-18(19)17-7-5-13-12-14(20-2)6-8-15(13)16(17)9-11-19;1-2(3)4/h6,8,12,16-18H,3-5,7,9-11H2,1-2H3;1H3,(H,3,4)
InChIKey VOWAZZOBJHTJFU-UHFFFAOYSA-N
Molecular Weight 330.2187
SMILES OC(C)=O.C1CC2C3CCCC3(C)CCC2c2ccc(OC)cc12
SPLASH splash10-00bc-3941000000-6770081290010ec7732a
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany