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isopropyl 4-({[5-(2-fluorophenyl)-2H-tetraazol-2-yl]acetyl}amino)benzoate
SpectraBase Compound ID AYRyBb3uTER
InChI InChI=1S/C19H18FN5O3/c1-12(2)28-19(27)13-7-9-14(10-8-13)21-17(26)11-25-23-18(22-24-25)15-5-3-4-6-16(15)20/h3-10,12H,11H2,1-2H3,(H,21,26)
InChIKey OOJXGZIJAXKQGA-UHFFFAOYSA-N
Mol Weight 383.38 g/mol
Molecular Formula C19H18FN5O3
Exact Mass 383.139368 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B0JZKs0K2Co
Name 4-[[2-[5-(2-fluorophenyl)-2-tetrazolyl]-1-oxoethyl]amino]benzoic acid propan-2-yl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H18FN5O3
InChI InChI=1S/C19H18FN5O3/c1-12(2)28-19(27)13-7-9-14(10-8-13)21-17(26)11-25-23-18(22-24-25)15-5-3-4-6-16(15)20/h3-10,12H,11H2,1-2H3,(H,21,26)
InChIKey OOJXGZIJAXKQGA-UHFFFAOYSA-N
Molecular Weight 383.383 g/mol
SMILES N(C(C[n]1nc(nn1)-c1c(F)cccc1)=O)c1ccc(C(OC(C)C)=O)cc1
SPLASH splash10-0fdk-1921000000-a6b5a9350448cafb1b8b
Synonyms isopropyl 4-[[2-[5-(2-fluorophenyl)tetrazol-2-yl]acetyl]amino]benzoate Propan-2-yl 4-[2-[5-(2-fluorophenyl)-1,2,3,4-tetrazol-2-yl]ethanoylamino]benzoate Propan-2-yl 4-[[2-[5-(2-fluorophenyl)tetrazol-2-yl]acetyl]amino]benzoate
Wiley ID 1452619