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(phenylmethyl) 2,3,4,7-tetrahydroazepine-1-carboxylate
SpectraBase Compound ID 2tJymqA0pC7
InChI InChI=1S/C14H17NO2/c16-14(15-10-6-1-2-7-11-15)17-12-13-8-4-3-5-9-13/h1,3-6,8-9H,2,7,10-12H2
InChIKey KOMDBNXFZQHCIS-UHFFFAOYSA-N
Mol Weight 231.29 g/mol
Molecular Formula C14H17NO2
Exact Mass 231.125929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1JgUfCYbL6H
Name (phenylmethyl) 2,3,4,7-tetrahydroazepine-1-carboxylate
Alternate Name(s) 2,3,4,7-tetrahydroazepine-1-carboxylic acid (phenylmethyl) ester 2,3,4,7-tetrahydroazepine-1-carboxylic acid benzyl ester benzyl 2,3,4,7-tetrahydro-1H-azepine-1-carboxylate benzyl 2,3,4,7-tetrahydroazepine-1-carboxylate
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Formula C14H17NO2
InChI InChI=1S/C14H17NO2/c16-14(15-10-6-1-2-7-11-15)17-12-13-8-4-3-5-9-13/h1,3-6,8-9H,2,7,10-12H2
InChIKey KOMDBNXFZQHCIS-UHFFFAOYSA-N
Molecular Weight 231.295 g/mol
SMILES C1N(CCCC=C1)C(=O)OCc1ccccc1
SPLASH splash10-0006-9500000000-f5fa3ed7d6196794a1f9
Source of Spectrum U-1993-653-6
Wiley ID 765184