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N-(azepan-1-yl)benzamide

View entire compound with spectra: 1 MS (GC)

N-(azepan-1-yl)benzamide
SpectraBase Compound ID CPhUiyiARf9
InChI InChI=1S/C13H18N2O/c16-13(12-8-4-3-5-9-12)14-15-10-6-1-2-7-11-15/h3-5,8-9H,1-2,6-7,10-11H2,(H,14,16)
InChIKey DIMLERKMVMHIEI-UHFFFAOYSA-N
Mol Weight 218.3 g/mol
Molecular Formula C13H18N2O
Exact Mass 218.141913 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DLFZAGKeyUs
Name N-(azepan-1-yl)benzamide
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 218.141913207 u
Formula C13H18N2O
InChI InChI=1S/C13H18N2O/c16-13(12-8-4-3-5-9-12)14-15-10-6-1-2-7-11-15/h3-5,8-9H,1-2,6-7,10-11H2,(H,14,16)
InChIKey DIMLERKMVMHIEI-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/chem.202300702
Molecular Weight 218.300 g/mol
Quality 235
Reported Formula C13H18N2O
SMILES N(N1CCCCCC1)C(C1=CC=CC=C1)=O
SPLASH splash10-0cdj-9700000000-db97c5c891924cd3ba5f
Source of Spectrum QE-29-SM6-13 (DOI: 10.1002/chem.202300702)
Wiley ID 1911992