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6-Benzamidohexanoic acid

View entire compound with spectra: 1 FTIR, 1 UV-Vis, and 3 MS (GC)

6-Benzamidohexanoic acid
SpectraBase Compound ID 8SPkRQeyGDQ
InChI InChI=1S/C13H17NO3/c15-12(16)9-5-2-6-10-14-13(17)11-7-3-1-4-8-11/h1,3-4,7-8H,2,5-6,9-10H2,(H,14,17)(H,15,16)
InChIKey LFCIOBCYMAQQBT-UHFFFAOYSA-N
Mol Weight 235.28 g/mol
Molecular Formula C13H17NO3
Exact Mass 235.120843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JerLYnV4gZ1
Name 6-Benzamidohexanoic acid
Alternate Name(s) N-Benzoyl-6-aminohexanoic acid 6-(Benzoylamino)hexanoic acid E-Benzamido coproic acid Hexanoic acid, .epsilon.-benzamido- Hexanoic acid, 6-(benzoylamino)-
CAS Registry Number 956-09-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17NO3
InChI InChI=1S/C13H17NO3/c15-12(16)9-5-2-6-10-14-13(17)11-7-3-1-4-8-11/h1,3-4,7-8H,2,5-6,9-10H2,(H,14,17)(H,15,16)
InChIKey LFCIOBCYMAQQBT-UHFFFAOYSA-N
Molecular Weight 235.283 g/mol
SMILES N(C(c1ccccc1)=O)CCCCCC(=O)O
SPLASH splash10-0a4i-5900000000-98b79a5b7d7142ed79b9
Wiley ID 1469488