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.alpha.-Zeranol, O'-methyl
SpectraBase Compound ID EoapMgzLGhU
InChI InChI=1S/C19H28O5/c1-13-7-6-10-15(20)9-5-3-4-8-14-11-16(23-2)12-17(21)18(14)19(22)24-13/h11-13,15,20-21H,3-10H2,1-2H3/t13-,15+/m0/s1
InChIKey ZOIYDULGILECSU-DZGCQCFKSA-N
Mol Weight 336.43 g/mol
Molecular Formula C19H28O5
Exact Mass 336.193674 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JdX3YA5b7Xd
Name .alpha.-Zeranol, O'-methyl
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 336.193673997 u
Formula C19H28O5
InChI InChI=1S/C19H28O5/c1-13-7-6-10-15(20)9-5-3-4-8-14-11-16(23-2)12-17(21)18(14)19(22)24-13/h11-13,15,20-21H,3-10H2,1-2H3/t13-,15+/m0/s1
InChIKey ZOIYDULGILECSU-DZGCQCFKSA-N
Molecular Weight 336.428 g/mol
Nominal Mass 336 u
Number of Peaks 44
SMILES Oc1c2C(O[C@](CCC[C@@](CCCCCc2cc(c1)OC)(O)[H])(C)[H])=O
SPLASH splash10-01sr-3921000000-d434bed4f897f63d6e5e
Source File Reference DSHS_50_0707
Source of Spectrum Dr. M.K.Parr, Dr. G.Opfermann, Prof. W.Schaenzer, DSHS Cologne, Germany
Synonyms .alpha.-Zearalanol, O'-methyl
Wiley ID 50_707