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3-Methyl-1,5-diphenyl-1H-pyrazole-4-carboxylic acid
SpectraBase Compound ID HHAIFQ6YlIY
InChI InChI=1S/C17H14N2O2/c1-12-15(17(20)21)16(13-8-4-2-5-9-13)19(18-12)14-10-6-3-7-11-14/h2-11H,1H3,(H,20,21)
InChIKey ZHGSMGISRFOLHO-UHFFFAOYSA-N
Mol Weight 278.31 g/mol
Molecular Formula C17H14N2O2
Exact Mass 278.105528 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AEvYE2EQ2dE
Name 3-Methyl-1,5-diphenyl-1H-pyrazole-4-carboxylic acid
Alternate Name(s) 3-Methyl-1,5-diphenyl-4-pyrazolecarboxylic acid 3-Methyl-1,5-diphenyl-pyrazole-4-carboxylic acid
CAS Registry Number 40030-35-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H14N2O2
InChI InChI=1S/C17H14N2O2/c1-12-15(17(20)21)16(13-8-4-2-5-9-13)19(18-12)14-10-6-3-7-11-14/h2-11H,1H3,(H,20,21)
InChIKey ZHGSMGISRFOLHO-UHFFFAOYSA-N
Molecular Weight 278.311 g/mol
SMILES OC(c1c([n](nc1C)-c1ccccc1)-c1ccccc1)=O
SPLASH splash10-004i-1090000000-55163b9cda74ae11fdbf
Source of Spectrum KC-1981-644-0
Wiley ID 1282198