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2'-Methylaminodeoxybenzoin-2-carboxylic acid
SpectraBase Compound ID FMbrmVwhU9b
InChI InChI=1S/C16H15NO3/c1-17-14-9-5-2-6-11(14)10-15(18)12-7-3-4-8-13(12)16(19)20/h2-9,17H,10H2,1H3,(H,19,20)
InChIKey RWMKOVIAHBXANK-UHFFFAOYSA-N
Mol Weight 269.3 g/mol
Molecular Formula C16H15NO3
Exact Mass 269.105193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7QbvWORX8OU
Name 2'-Methylaminodeoxybenzoin-2-carboxylic acid
Alternate Name(s) 2-{[2-(methylamino)phenyl]acetyl}benzoic acid
Comments Less than 3 mono-isotopic peaks
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Formula C16H15NO3
InChI InChI=1S/C16H15NO3/c1-17-14-9-5-2-6-11(14)10-15(18)12-7-3-4-8-13(12)16(19)20/h2-9,17H,10H2,1H3,(H,19,20)
InChIKey RWMKOVIAHBXANK-UHFFFAOYSA-N
Molecular Weight 269.300 g/mol
SMILES OC(c1c(C(Cc2c(cccc2)NC)=O)cccc1)=O
SPLASH splash10-0159-0690000000-b7685c03af019bdc05d5
Source of Spectrum KC-0-1719-11
Wiley ID 825299