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[[5-(2-Phenylquinolin-4-yl)-4H-[1,2,4]triazol-3-ylsulfanyl]acetic acid
SpectraBase Compound ID 8GLPXcQDIcb
InChI InChI=1S/C19H14N4O2S/c24-17(25)11-26-19-21-18(22-23-19)14-10-16(12-6-2-1-3-7-12)20-15-9-5-4-8-13(14)15/h1-10H,11H2,(H,24,25)(H,21,22,23)
InChIKey FWLQAFZJRUZSEX-UHFFFAOYSA-N
Mol Weight 362.41 g/mol
Molecular Formula C19H14N4O2S
Exact Mass 362.083747 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5tIAOe7kYoP
Name [[5-(2-Phenylquinolin-4-yl)-4H-[1,2,4]triazol-3-ylsulfanyl]acetic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H14N4O2S
InChI InChI=1S/C19H14N4O2S/c24-17(25)11-26-19-21-18(22-23-19)14-10-16(12-6-2-1-3-7-12)20-15-9-5-4-8-13(14)15/h1-10H,11H2,(H,24,25)(H,21,22,23)
InChIKey FWLQAFZJRUZSEX-UHFFFAOYSA-N
Molecular Weight 362.407 g/mol
SMILES [nH]1c(SCC(O)=O)nnc1-c1cc(-c2ccccc2)nc2ccccc12
SPLASH splash10-0036-7298000000-bc196dec611403a9bda5
Source of Spectrum NP-13-2134-0
Synonyms 2-[[5-(2-phenyl-4-quinolinyl)-1H-1,2,4-triazol-3-yl]thio]acetic acid 2-[[5-(2-phenylquinolin-4-yl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetic acid 2-[[5-(2-phenyl-4-quinolyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetic acid 2-[[5-(2-phenylquinolin-4-yl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanoic acid
Wiley ID 1110899