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1-(4-Bromobenzyl)pyrazole-3-carboxylic acid ethyl ester
SpectraBase Compound ID EqEop1IOOG9
InChI InChI=1S/C13H13BrN2O2/c1-2-18-13(17)12-7-8-16(15-12)9-10-3-5-11(14)6-4-10/h3-8H,2,9H2,1H3
InChIKey WYXITFQFBRTZFX-UHFFFAOYSA-N
Mol Weight 309.16 g/mol
Molecular Formula C13H13BrN2O2
Exact Mass 308.016041 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4oZkYLRFqUr
Name 1-(4-Bromobenzyl)pyrazole-3-carboxylic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13BrN2O2
InChI InChI=1S/C13H13BrN2O2/c1-2-18-13(17)12-7-8-16(15-12)9-10-3-5-11(14)6-4-10/h3-8H,2,9H2,1H3
InChIKey WYXITFQFBRTZFX-UHFFFAOYSA-N
Molecular Weight 309.163 g/mol
SMILES c1(n[n](Cc2ccc(cc2)Br)cc1)C(=O)OCC
SPLASH splash10-014i-4901000000-69de584dd391fb0d17f9
Source of Spectrum QC-24-1458-9
Synonyms 1-(1-Bromobenzyl)pyrazole-3-carboxylic acid ethyl ester Ethyl 1-(4-bromobenzyl)-1H-pyrazole-3-carboxylate
Wiley ID 1584252