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1H-Pyrazole-1-acetic acid, 4-[(3-chlorobenzoyl)amino]-3,5-dimethyl-, ethyl ester
SpectraBase Compound ID Fmtjp0AEDP1
InChI InChI=1S/C16H18ClN3O3/c1-4-23-14(21)9-20-11(3)15(10(2)19-20)18-16(22)12-6-5-7-13(17)8-12/h5-8H,4,9H2,1-3H3,(H,18,22)
InChIKey DFUBHWWXOYQSBH-UHFFFAOYSA-N
Mol Weight 335.79 g/mol
Molecular Formula C16H18ClN3O3
Exact Mass 335.103669 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dakb9YYpZo3
Name 1H-Pyrazole-1-acetic acid, 4-[(3-chlorobenzoyl)amino]-3,5-dimethyl-, ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18ClN3O3
InChI InChI=1S/C16H18ClN3O3/c1-4-23-14(21)9-20-11(3)15(10(2)19-20)18-16(22)12-6-5-7-13(17)8-12/h5-8H,4,9H2,1-3H3,(H,18,22)
InChIKey DFUBHWWXOYQSBH-UHFFFAOYSA-N
Molecular Weight 335.791 g/mol
SMILES N(c1c([n](nc1C)CC(=O)OCC)C)C(c1cc(Cl)ccc1)=O
SPLASH splash10-000e-5900000000-f8ee3c76a30078f062d8
Source of Spectrum IY-1-4468-3
Synonyms 2-[4-[[(3-chlorophenyl)-oxomethyl]amino]-3,5-dimethyl-1-pyrazolyl]acetic acid ethyl ester Ethyl 2-[4-[(3-chlorobenzoyl)amino]-3,5-dimethylpyrazol-1-yl]acetate Ethyl 2-[4-[(3-chlorobenzoyl)amino]-3,5-dimethyl-pyrazol-1-yl]acetate Ethyl 2-[4-[(3-chlorophenyl)carbonylamino]-3,5-dimethyl-pyrazol-1-yl]ethanoate
Wiley ID 1652666