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2-[(Cyclohexylcarbamoyl)methyl]benzoic acid
SpectraBase Compound ID 2p3EjrSY98u
InChI InChI=1S/C15H19NO3/c17-14(16-12-7-2-1-3-8-12)10-11-6-4-5-9-13(11)15(18)19/h4-6,9,12H,1-3,7-8,10H2,(H,16,17)(H,18,19)
InChIKey BTGJLJQXYDSPME-UHFFFAOYSA-N
Mol Weight 261.32 g/mol
Molecular Formula C15H19NO3
Exact Mass 261.136493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3mIOQhEhxBf
Name 2-[(Cyclohexylcarbamoyl)methyl]benzoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H19NO3
InChI InChI=1S/C15H19NO3/c17-14(16-12-7-2-1-3-8-12)10-11-6-4-5-9-13(11)15(18)19/h4-6,9,12H,1-3,7-8,10H2,(H,16,17)(H,18,19)
InChIKey BTGJLJQXYDSPME-UHFFFAOYSA-N
Molecular Weight 261.321 g/mol
SMILES N(C(Cc1c(C(=O)O)cccc1)=O)C1CCCCC1
SPLASH splash10-000i-0910000000-2412933a6dae4bbd9a08
Source of Spectrum F4-0-3097-21
Synonyms 2-[2-(cyclohexylamino)-2-oxoethyl]benzoic acid
Wiley ID 1620650