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Benzoic acid, 4-[[[5-methyl-1-(phenylmethyl)-1H-pyrazol-3-yl]amino]carbonyl]-, methyl ester
SpectraBase Compound ID IQWTPqo1sNW
InChI InChI=1S/C20H19N3O3/c1-14-12-18(22-23(14)13-15-6-4-3-5-7-15)21-19(24)16-8-10-17(11-9-16)20(25)26-2/h3-12H,13H2,1-2H3,(H,21,22,24)
InChIKey QDZKKYJQVMMEPT-UHFFFAOYSA-N
Mol Weight 349.39 g/mol
Molecular Formula C20H19N3O3
Exact Mass 349.142641 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5Db89m0nWS
Name Benzoic acid, 4-[[[5-methyl-1-(phenylmethyl)-1H-pyrazol-3-yl]amino]carbonyl]-, methyl ester
Alternate Name(s) 4-[[[5-methyl-1-(phenylmethyl)-3-pyrazolyl]amino]-oxomethyl]benzoic acid methyl ester Methyl 4-[(1-benzyl-5-methylpyrazol-3-yl)carbamoyl]benzoate Methyl 4-[(1-benzyl-5-methyl-pyrazol-3-yl)carbamoyl]benzoate Methyl 4-[[5-methyl-1-(phenylmethyl)pyrazol-3-yl]carbamoyl]benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H19N3O3
InChI InChI=1S/C20H19N3O3/c1-14-12-18(22-23(14)13-15-6-4-3-5-7-15)21-19(24)16-8-10-17(11-9-16)20(25)26-2/h3-12H,13H2,1-2H3,(H,21,22,24)
InChIKey QDZKKYJQVMMEPT-UHFFFAOYSA-N
Molecular Weight 349.390 g/mol
SMILES N(c1cc([n](n1)Cc1ccccc1)C)C(=O)c1ccc(cc1)C(OC)=O
SPLASH splash10-01ox-9804000000-3ccba2e444986efd1dfa
Source of Spectrum IY-1-4342-9
Wiley ID 1651412