CID 11194901

2-amino-5,7-dimethoxy-1,2,4-triazolo[1,5-a]pyrimidine

Structural Information

Molecular Formula
C7H9N5O2
SMILES
COC1=CC(=NC2=NC(=NN12)N)OC
InChI
InChI=1S/C7H9N5O2/c1-13-4-3-5(14-2)12-7(9-4)10-6(8)11-12/h3H,1-2H3,(H2,8,11)
InChIKey
SJEIPAUSEWIHJI-UHFFFAOYSA-N
Compound name
5,7-dimethoxy-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

49
Patents

195.07562 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.08290 138.7
[M+Na]+ 218.06484 151.2
[M-H]- 194.06834 139.0
[M+NH4]+ 213.10944 155.8
[M+K]+ 234.03878 148.8
[M+H-H2O]+ 178.07288 130.4
[M+HCOO]- 240.07382 161.5
[M+CH3COO]- 254.08947 185.5
[M+Na-2H]- 216.05029 146.7
[M]+ 195.07507 143.3
[M]- 195.07617 143.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe