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Ethyl 2,3,5,6-tetrafluoro-4-(4-(hydroxymethyl)-1H-1,2,3-triazol-1-yl)benzoate

View entire compound with spectra: 1 MS (GC)

Ethyl 2,3,5,6-tetrafluoro-4-(4-(hydroxymethyl)-1H-1,2,3-triazol-1-yl)benzoate
SpectraBase Compound ID AmKhef3O2eL
InChI InChI=1S/C12H9F4N3O3/c1-2-22-12(21)6-7(13)9(15)11(10(16)8(6)14)19-3-5(4-20)17-18-19/h3,20H,2,4H2,1H3
InChIKey IPAZEFNZMAJVCX-UHFFFAOYSA-N
Mol Weight 319.22 g/mol
Molecular Formula C12H9F4N3O3
Exact Mass 319.058004 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8potuzDs3xS
Name Ethyl 2,3,5,6-tetrafluoro-4[4-(hydroxymethyl)-1H-1,2,3-triazol-1-yl]benzoate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H9F4N3O3
InChI InChI=1S/C12H9F4N3O3/c1-2-22-12(21)6-7(13)9(15)11(10(16)8(6)14)19-3-5(4-20)17-18-19/h3,20H,2,4H2,1H3
InChIKey IPAZEFNZMAJVCX-UHFFFAOYSA-N
Literature Reference DOI 10.1016/j.jfluchem.2016.05.005
Molecular Weight 319.216 g/mol
SMILES OCc1nn[n](c1)-c1c(c(c(C(=O)OCC)c(c1F)F)F)F
SPLASH splash10-0201-2390000000-b09c39f3cf77c8ee12dd
Source of Spectrum Nikolai N. Solodukhin, et al. FLUOR, doi:10.1016/j.jfluchem.2016.05.005
Synonyms Ethyl 2,3,5,6-tetrafluoro-4-(4-(hydroxymethyl)-1H-1,2,3-triazol-1-yl)benzoate
Wiley ID 1816052