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Ethyl 1H-azepine-1-carboxylate
SpectraBase Compound ID Cb5ZZchErnq
InChI InChI=1S/C9H11NO2/c1-2-12-9(11)10-7-5-3-4-6-8-10/h3-8H,2H2,1H3
InChIKey CABWYTRTVSNYIF-UHFFFAOYSA-N
Mol Weight 165.19 g/mol
Molecular Formula C9H11NO2
Exact Mass 165.078979 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HY7qvmL0w0E
Name Ethyl 1H-azepine-1-carboxylate
CAS Registry Number 2955-79-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H11NO2
InChI InChI=1S/C9H11NO2/c1-2-12-9(11)10-7-5-3-4-6-8-10/h3-8H,2H2,1H3
InChIKey CABWYTRTVSNYIF-UHFFFAOYSA-N
Molecular Weight 165.192 g/mol
SMILES C1=CN(C=CC=C1)C(=O)OCC
SPLASH splash10-014l-9300000000-e2539fb9243606940352
Source of Spectrum O-23-241-1
Synonyms 1-Azepinecarboxylic acid ethyl ester azepine-1-carboxylic acid ethyl ester Ethyl azepine-1-carboxylate N-Ethoxycarbonyl-1H-azepine
Wiley ID 1161510