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3-{5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}propanoic acid
SpectraBase Compound ID BkQzWzevwMc
InChI InChI=1S/C10H12N4O2/c1-6-8(3-4-9(15)16)7(2)14-10(13-6)11-5-12-14/h5H,3-4H2,1-2H3,(H,15,16)
InChIKey NWSSSDXVQWXROX-UHFFFAOYSA-N
Mol Weight 220.23 g/mol
Molecular Formula C10H12N4O2
Exact Mass 220.096026 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CF77s6WqlrG
Name 3-{5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl}propanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12N4O2
InChI InChI=1S/C10H12N4O2/c1-6-8(3-4-9(15)16)7(2)14-10(13-6)11-5-12-14/h5H,3-4H2,1-2H3,(H,15,16)
InChIKey NWSSSDXVQWXROX-UHFFFAOYSA-N
Molecular Weight 220.232 g/mol
SMILES OC(CCC=1C(=Nc2[n](C1C)ncn2)C)=O
SPLASH splash10-03di-9510000000-b7bb9e991d106cfdffe5
Source of Spectrum IY-2-4916-9
Synonyms [1,2,4]Triazolo[1,5-a]pyrimidine-6-propanoic acid, 5,7-dimethyl- 3-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanoic acid
Wiley ID 1657152