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1H-Indole-3-propanoic acid, 4-chloro-.alpha.-(hydroxyimino)-, ethyl ester
SpectraBase Compound ID Efaf5si48z9
InChI InChI=1S/C13H13ClN2O3/c1-2-19-13(17)11(16-18)6-8-7-15-10-5-3-4-9(14)12(8)10/h3-5,7,15,18H,2,6H2,1H3/b16-11-
InChIKey TZRKMYGXFDVDGR-WJDWOHSUSA-N
Mol Weight 280.71 g/mol
Molecular Formula C13H13ClN2O3
Exact Mass 280.06147 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JmCfGe72mk3
Name 1H-Indole-3-propanoic acid, 4-chloro-.alpha.-(hydroxyimino)-, ethyl ester
CAS Registry Number 121994-45-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13ClN2O3
InChI InChI=1S/C13H13ClN2O3/c1-2-19-13(17)11(16-18)6-8-7-15-10-5-3-4-9(14)12(8)10/h3-5,7,15,18H,2,6H2,1H3/b16-11-
InChIKey TZRKMYGXFDVDGR-WJDWOHSUSA-N
Molecular Weight 280.711 g/mol
SMILES [nH]1c2c(c(C\C(=N\O)C(=O)OCC)c1)c(ccc2)Cl
SPLASH splash10-03dl-0950000000-50d02923c4e50f7f51e0
Source of Spectrum F-44-6498-10
Synonyms Ethyl (2Z)-3-(4-chloro-1H-indol-3-yl)-2-(hydroxyimino)propanoate Ethyl .alpha.-(hydroxyimino)-.beta.(4-chloroindol-3-yl)propanoate
Wiley ID 1283508