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2-(4-phenyl-2-triazolyl)acetic acid ethyl ester

View entire compound with spectra: 1 MS (GC)

2-(4-phenyl-2-triazolyl)acetic acid ethyl ester
SpectraBase Compound ID 95rAKYkQOl7
InChI InChI=1S/C12H13N3O2/c1-2-17-12(16)9-15-13-8-11(14-15)10-6-4-3-5-7-10/h3-8H,2,9H2,1H3
InChIKey GWJVDVKFZHSREH-UHFFFAOYSA-N
Mol Weight 231.25 g/mol
Molecular Formula C12H13N3O2
Exact Mass 231.100777 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1hQKTINIvIo
Name 2-(4-phenyl-2-triazolyl)acetic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13N3O2
InChI InChI=1S/C12H13N3O2/c1-2-17-12(16)9-15-13-8-11(14-15)10-6-4-3-5-7-10/h3-8H,2,9H2,1H3
InChIKey GWJVDVKFZHSREH-UHFFFAOYSA-N
Molecular Weight 231.255 g/mol
SMILES c1(n[n](nc1)CC(=O)OCC)-c1ccccc1
SPLASH splash10-053r-0950000000-b8abd5346ac56e7b79a3
Source of Spectrum F-47-9790-17
Synonyms 2-(4-phenyltriazol-2-yl)acetic acid ethyl ester Ethyl 2-(4-phenyl-1,2,3-triazol-2-yl)ethanoate Ethyl 2-(4-phenyltriazol-2-yl)acetate
Wiley ID 1232683