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Benzyl 4-(2-methoxy-2-oxoethyl)-1H-pyrazole-3-carboxylate
SpectraBase Compound ID JqrE4HGnKTb
InChI InChI=1S/C14H14N2O4/c1-19-12(17)7-11-8-15-16-13(11)14(18)20-9-10-5-3-2-4-6-10/h2-6,8H,7,9H2,1H3,(H,15,16)
InChIKey OUIMRUUJCYDABI-UHFFFAOYSA-N
Mol Weight 274.28 g/mol
Molecular Formula C14H14N2O4
Exact Mass 274.095357 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 552Oh4Fo1Ex
Name Benzyl 4-(2-methoxy-2-oxoethyl)-1H-pyrazole-3-carboxylate
CAS Registry Number 187530-11-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14N2O4
InChI InChI=1S/C14H14N2O4/c1-19-12(17)7-11-8-15-16-13(11)14(18)20-9-10-5-3-2-4-6-10/h2-6,8H,7,9H2,1H3,(H,15,16)
InChIKey OUIMRUUJCYDABI-UHFFFAOYSA-N
Molecular Weight 274.276 g/mol
SMILES [nH]1cc(c(n1)C(OCc1ccccc1)=O)CC(=O)OC
SPLASH splash10-0006-9610000000-98c01d329c0773e18885
Source of Spectrum AD-0-2532-0
Synonyms (phenylmethyl) 4-(2-methoxy-2-oxidanylidene-ethyl)-1H-pyrazole-5-carboxylate 4-(2-keto-2-methoxy-ethyl)-1H-pyrazole-5-carboxylic acid benzyl ester 4-(2-Methoxy-2-oxoethyl)-1H-pyrazole-5-carboxylic acid (phenylmethyl) ester benzyl 4-(2-methoxy-2-oxo-ethyl)-1H-pyrazole-5-carboxylate Pyrazole-3-carboxylic acid, 4-methoxycarbonylmethyl-, benzyl ester
Wiley ID 1425629