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Benzyl 7-(methoxy(methyl)carbamoyl)-2,3,4,5-tetrahydro-1H-azepine-1-carboxylate
SpectraBase Compound ID 71j9rB2sT5Y
InChI InChI=1S/C17H22N2O4/c1-18(22-2)16(20)15-11-7-4-8-12-19(15)17(21)23-13-14-9-5-3-6-10-14/h3,5-6,9-11H,4,7-8,12-13H2,1-2H3
InChIKey CVDRJJBBWDVAPC-UHFFFAOYSA-N
Mol Weight 318.37 g/mol
Molecular Formula C17H22N2O4
Exact Mass 318.157957 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3PHgPYZYTTr
Name Benzyl 7-(methoxy(methyl)carbamoyl)-2,3,4,5-tetrahydro-1H-azepine-1-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22N2O4
InChI InChI=1S/C17H22N2O4/c1-18(22-2)16(20)15-11-7-4-8-12-19(15)17(21)23-13-14-9-5-3-6-10-14/h3,5-6,9-11H,4,7-8,12-13H2,1-2H3
InChIKey CVDRJJBBWDVAPC-UHFFFAOYSA-N
Molecular Weight 318.373 g/mol
SMILES C=1(N(C(OCc2ccccc2)=O)CCCCC1)C(N(OC)C)=O
SPLASH splash10-052f-9520000000-5fa8b369493642d79bf8
Source of Spectrum J-73-1944-2f
Synonyms 7-[[methoxy(methyl)amino]-oxomethyl]-2,3,4,5-tetrahydroazepine-1-carboxylic acid (phenylmethyl) ester benzyl 7-[methoxy(methyl)carbamoyl]-2,3,4,5-tetrahydroazepine-1-carboxylate (phenylmethyl) 7-[methoxy(methyl)carbamoyl]-2,3,4,5-tetrahydroazepine-1-carboxylate
Wiley ID 1668103