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1,2,3,4-Butanetetrol, 1-[2-(2-fluorophenyl)-2H-1,2,3-triazol-4-yl]-, [1R-(1R*,2S*,3R*)]-
SpectraBase Compound ID 6GmyXnYHWGe
InChI InChI=1S/C12H14FN3O4/c13-7-3-1-2-4-9(7)16-14-5-8(15-16)11(19)12(20)10(18)6-17/h1-5,10-12,17-20H,6H2
InChIKey GUACULBKHHAZAP-UHFFFAOYSA-N
Mol Weight 283.26 g/mol
Molecular Formula C12H14FN3O4
Exact Mass 283.096834 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5MVffCJ5PBU
Name 1,2,3,4-Butanetetrol, 1-[2-(2-fluorophenyl)-2H-1,2,3-triazol-4-yl]-, [1R-(1R*,2S*,3R*)]-
CAS Registry Number 51306-42-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14FN3O4
InChI InChI=1S/C12H14FN3O4/c13-7-3-1-2-4-9(7)16-14-5-8(15-16)11(19)12(20)10(18)6-17/h1-5,10-12,17-20H,6H2
InChIKey GUACULBKHHAZAP-UHFFFAOYSA-N
Molecular Weight 283.259 g/mol
SMILES OCC(C(C(c1cn[n](-c2ccccc2F)n1)O)O)O
SPLASH splash10-0006-2910000000-62df64c0342467ac4f9a
Source of Spectrum AU-30-402-3
Synonyms 1-[2-(2-Fluorophenyl)-2H-1,2,3-triazol-4-yl]-1,2,3,4-butanetetrol 1-[2-(2-fluorophenyl)-1,2,3-triazol-4-yl]butane-1,2,3,4-tetrol 1-[2-(2-fluorophenyl)-4-triazolyl]butane-1,2,3,4-tetrol 1-[2-(2-fluorophenyl)triazol-4-yl]butane-1,2,3,4-tetrol
Wiley ID 1286708