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1H-Pyrazole-3-carboxylic acid, 1-[(3-chlorophenyl)methyl]-, methyl ester
SpectraBase Compound ID LG3IIr3kwnF
InChI InChI=1S/C12H11ClN2O2/c1-17-12(16)11-5-6-15(14-11)8-9-3-2-4-10(13)7-9/h2-7H,8H2,1H3
InChIKey GPWTXGZBRVWFJA-UHFFFAOYSA-N
Mol Weight 250.68 g/mol
Molecular Formula C12H11ClN2O2
Exact Mass 250.050905 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KEfshbT63eE
Name 1H-Pyrazole-3-carboxylic acid, 1-[(3-chlorophenyl)methyl]-, methyl ester
Alternate Name(s) 1-[(3-chlorophenyl)methyl]-3-pyrazolecarboxylic acid methyl ester Methyl 1-[(3-chlorophenyl)methyl]pyrazole-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11ClN2O2
InChI InChI=1S/C12H11ClN2O2/c1-17-12(16)11-5-6-15(14-11)8-9-3-2-4-10(13)7-9/h2-7H,8H2,1H3
InChIKey GPWTXGZBRVWFJA-UHFFFAOYSA-N
Molecular Weight 250.685 g/mol
SMILES c1c(C[n]2ccc(C(OC)=O)n2)cc(cc1)Cl
SPLASH splash10-0fvi-5960000000-4c431d577698959f6983
Source of Spectrum IY-2-4724-1
Wiley ID 1655224