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2,5-Dimethyl-1-azepinecarboxylic acid methyl ester
SpectraBase Compound ID LSfHQCKwyuf
InChI InChI=1S/C10H13NO2/c1-8-4-5-9(2)11(7-6-8)10(12)13-3/h4-7H,1-3H3
InChIKey IXKIFBLGNPXFJY-UHFFFAOYSA-N
Mol Weight 179.22 g/mol
Molecular Formula C10H13NO2
Exact Mass 179.094629 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8TuYcbKs0ui
Name 2,5-Dimethyl-1-azepinecarboxylic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H13NO2
InChI InChI=1S/C10H13NO2/c1-8-4-5-9(2)11(7-6-8)10(12)13-3/h4-7H,1-3H3
InChIKey IXKIFBLGNPXFJY-UHFFFAOYSA-N
Molecular Weight 179.219 g/mol
SMILES C(N1C=CC(C)=CC=C1C)(=O)OC
SPLASH splash10-00fv-6900000000-74e075408d556480db1e
Source of Spectrum EP-5619-0-0
Synonyms 2,5-Dimethylazepine-1-carboxylic acid methyl ester Methyl 2,5-dimethylazepine-1-carboxylate
Wiley ID 1175236