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[1,2,4]Triazolo[1,5-a]pyrimidinium, 1,2-dihydro-3-(3-hydroxypropyl)-5,7-dimethyl-2-oxo-, hydroxide, inner salt
SpectraBase Compound ID 1YfDQZUOo6k
InChI InChI=1S/C10H14N4O2/c1-7-6-8(2)14-9(11-7)13(4-3-5-15)10(16)12-14/h6,15H,3-5H2,1-2H3
InChIKey FPXYBNHTMYEDJD-UHFFFAOYSA-N
Mol Weight 222.25 g/mol
Molecular Formula C10H14N4O2
Exact Mass 222.111676 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BIYjy4BKN3o
Name [1,2,4]Triazolo[1,5-a]pyrimidinium, 1,2-dihydro-3-(3-hydroxypropyl)-5,7-dimethyl-2-oxo-, hydroxide, inner salt
Alternate Name(s) 1-(3-hydroxypropyl)-5,7-dimethyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-4-ium-2-olate 3-(3-Hydroxypropyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidinium-2-olate
CAS Registry Number 126085-76-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H14N4O2
InChI InChI=1S/C10H14N4O2/c1-7-6-8(2)14-9(11-7)13(4-3-5-15)10(16)12-14/h6,15H,3-5H2,1-2H3
InChIKey FPXYBNHTMYEDJD-UHFFFAOYSA-N
Molecular Weight 222.248 g/mol
SMILES OCCC[n]1c2[n+](nc1[O-])c(cc(C)n2)C
SPLASH splash10-07g0-0910000000-300241f338d1b04a29b0
Source of Spectrum KC-1989-1731-3
Wiley ID 1221906