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Benzeneacetic acid, .alpha.-[(cyclopropylmethylene)amino]-, methyl ester
SpectraBase Compound ID 8Z5RXtUYRwv
InChI InChI=1S/C13H15NO2/c1-16-13(15)12(14-9-10-7-8-10)11-5-3-2-4-6-11/h2-6,9-10,12H,7-8H2,1H3/b14-9+
InChIKey BHPCAVBNFDKAST-NTEUORMPSA-N
Mol Weight 217.27 g/mol
Molecular Formula C13H15NO2
Exact Mass 217.110279 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D8xFEBs63o8
Name Benzeneacetic acid, .alpha.-[(cyclopropylmethylene)amino]-, methyl ester
Alternate Name(s) Methyl N-cyclopropylidene phenylglycine Methyl {[(E)-cyclopropylmethylidene]amino}(phenyl)acetate
CAS Registry Number 118317-26-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15NO2
InChI InChI=1S/C13H15NO2/c1-16-13(15)12(14-9-10-7-8-10)11-5-3-2-4-6-11/h2-6,9-10,12H,7-8H2,1H3/b14-9+
InChIKey BHPCAVBNFDKAST-NTEUORMPSA-N
Molecular Weight 217.268 g/mol
SMILES C(\N=C\C1CC1)(C(=O)OC)c1ccccc1
SPLASH splash10-0a4i-1900000000-7fc64a4749fa517ec8fd
Source of Spectrum F-44-1530-1
Wiley ID 1216660