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2-[4-(1-Phenyl-3-methylpyrazolyl)]-4-thiazolylacetic Acid
SpectraBase Compound ID LYFLqm55OJa
InChI InChI=1S/C15H13N3O2S/c1-10-12(13-9-21-14(16-13)7-15(19)20)8-18(17-10)11-5-3-2-4-6-11/h2-6,8-9H,7H2,1H3,(H,19,20)
InChIKey YTGKVTRFYIBFIU-UHFFFAOYSA-N
Mol Weight 299.35 g/mol
Molecular Formula C15H13N3O2S
Exact Mass 299.072848 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3FUxjCl9noz
Name 2-[4-(1-Phenyl-3-methylpyrazolyl)]-4-thiazolylacetic Acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H13N3O2S
InChI InChI=1S/C15H13N3O2S/c1-10-12(13-9-21-14(16-13)7-15(19)20)8-18(17-10)11-5-3-2-4-6-11/h2-6,8-9H,7H2,1H3,(H,19,20)
InChIKey YTGKVTRFYIBFIU-UHFFFAOYSA-N
Molecular Weight 299.348 g/mol
SMILES OC(Cc1nc(-c2c[n](-c3ccccc3)nc2C)cs1)=O
SPLASH splash10-052b-0291000000-6e4246f513b22fd0c827
Source of Spectrum Y-28-1611-16
Synonyms 2-[4'-(1'-phenyl-3'-methylpyrazolyl)-4'-thiazolyl]acetic acid [4-(3-methyl-1-phenyl-1H-pyrazol-4-yl)-1,3-thiazol-2-yl]acetic acid
Wiley ID 1301841