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(E)-3-(2-keto-7-methyl-1H-quinolin-3-yl)acrylic acid
SpectraBase Compound ID KfFpT55vTHs
InChI InChI=1S/C13H11NO3/c1-8-2-3-9-7-10(4-5-12(15)16)13(17)14-11(9)6-8/h2-7H,1H3,(H,14,17)(H,15,16)/b5-4+
InChIKey PXACMPAZXVTQLQ-SNAWJCMRSA-N
Mol Weight 229.23 g/mol
Molecular Formula C13H11NO3
Exact Mass 229.073893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 61ccHyK4mzw
Name (E)-3-(2-keto-7-methyl-1H-quinolin-3-yl)acrylic acid
CAS Registry Number 80231-55-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H11NO3
InChI InChI=1S/C13H11NO3/c1-8-2-3-9-7-10(4-5-12(15)16)13(17)14-11(9)6-8/h2-7H,1H3,(H,14,17)(H,15,16)/b5-4+
InChIKey PXACMPAZXVTQLQ-SNAWJCMRSA-N
Molecular Weight 229.235 g/mol
SMILES N1c2c(C=C(\C=C\C(=O)O)C1=O)ccc(c2)C
SPLASH splash10-001i-0910000000-c5b0a5720e697cfcb226
Source of Spectrum KC-1981-2515-0
Synonyms (E)-3-(7-methyl-2-oxidanylidene-1H-quinolin-3-yl)prop-2-enoic acid (E)-3-(7-methyl-2-oxo-1H-quinolin-3-yl)-2-propenoic acid (E)-3-(7-methyl-2-oxo-1H-quinolin-3-yl)prop-2-enoic acid
Wiley ID 1230751