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4-[2-(dimethylamino)-2-oxoethyl]benzoic acid
SpectraBase Compound ID IxdV0qF2fVd
InChI InChI=1S/C11H13NO3/c1-12(2)10(13)7-8-3-5-9(6-4-8)11(14)15/h3-6H,7H2,1-2H3,(H,14,15)
InChIKey LJTQUFHONBMKSS-UHFFFAOYSA-N
Mol Weight 207.23 g/mol
Molecular Formula C11H13NO3
Exact Mass 207.089543 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5YeCnhhBSeK
Name 4-[2-(dimethylamino)-2-oxoethyl]benzoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H13NO3
InChI InChI=1S/C11H13NO3/c1-12(2)10(13)7-8-3-5-9(6-4-8)11(14)15/h3-6H,7H2,1-2H3,(H,14,15)
InChIKey LJTQUFHONBMKSS-UHFFFAOYSA-N
Molecular Weight 207.229 g/mol
SMILES OC(c1ccc(CC(N(C)C)=O)cc1)=O
SPLASH splash10-00di-9100000000-c0d7ae8ae5d9953cebf0
Source of Spectrum AC-1993-115-3
Synonyms 4-[2-(dimethylamino)-2-oxo-ethyl]benzoic acid 4-[2-(dimethylamino)-2-oxidanylidene-ethyl]benzoic acid
Wiley ID 811550