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.beta.-Zeranol, O',O''-dimethyl
SpectraBase Compound ID Lbda7buTnig
InChI InChI=1S/C20H30O5/c1-14-8-7-11-16(21)10-6-4-5-9-15-12-17(23-2)13-18(24-3)19(15)20(22)25-14/h12-14,16,21H,4-11H2,1-3H3/t14-,16-/m0/s1
InChIKey XGZFGCRWBLVDFU-HOCLYGCPSA-N
Mol Weight 350.46 g/mol
Molecular Formula C20H30O5
Exact Mass 350.209324 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IYC9XAiW67b
Name .beta.-Zeranol, O',O''-dimethyl
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 350.209324061 u
Formula C20H30O5
InChI InChI=1S/C20H30O5/c1-14-8-7-11-16(21)10-6-4-5-9-15-12-17(23-2)13-18(24-3)19(15)20(22)25-14/h12-14,16,21H,4-11H2,1-3H3/t14-,16-/m0/s1
InChIKey XGZFGCRWBLVDFU-HOCLYGCPSA-N
Molecular Weight 350.455 g/mol
Nominal Mass 350 u
Number of Peaks 44
SMILES O[C@]1(CCCCCc2c(c(cc(c2)OC)OC)C(=O)O[C@@](C)(CCC1)[H])[H]
SPLASH splash10-0udl-2952000000-aebf8393f26932d3466f
Source File Reference DSHS_50_0708
Source of Spectrum Dr. M.K.Parr, Dr. G.Opfermann, Prof. W.Schaenzer, DSHS Cologne, Germany
Synonyms .beta.-Zearalanol, O',O''-dimethyl
Wiley ID 50_708