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4-(diethylcarbamoyl)-2-methyl-benzoic acid
SpectraBase Compound ID FX4S8OxoHW9
InChI InChI=1S/C13H17NO3/c1-4-14(5-2)12(15)10-6-7-11(13(16)17)9(3)8-10/h6-8H,4-5H2,1-3H3,(H,16,17)
InChIKey UDTDESFPMRTVKQ-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 B0mbEx7TL65
Name 4-(diethylcarbamoyl)-2-methyl-benzoic acid
Alternate Name(s) 4-[(diethylamino)carbonyl]-2-methylbenzoic acid 4-[diethylamino(oxo)methyl]-2-methylbenzoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17NO3
InChI InChI=1S/C13H17NO3/c1-4-14(5-2)12(15)10-6-7-11(13(16)17)9(3)8-10/h6-8H,4-5H2,1-3H3,(H,16,17)
InChIKey UDTDESFPMRTVKQ-UHFFFAOYSA-N
Molecular Weight 235.283 g/mol
SMILES OC(c1ccc(C(N(CC)CC)=O)cc1C)=O
SPLASH splash10-03e9-0690000000-e22d241864f23eb51217
Source of Spectrum KC-0-1268-6
Wiley ID 783684