CID 131302962

Ethyl 2-amino-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate

Structural Information

Molecular Formula
C8H9N5O2
SMILES
CCOC(=O)C1=CN2C(=NC(=N2)N)N=C1
InChI
InChI=1S/C8H9N5O2/c1-2-15-6(14)5-3-10-8-11-7(9)12-13(8)4-5/h3-4H,2H2,1H3,(H2,9,12)
InChIKey
FWUZBQUQCAMIST-UHFFFAOYSA-N
Compound name
ethyl 2-amino-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

207.07562 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.082896 142.4
[M+Na]+ 230.064838 153.6
[M-H]- 206.068344 142.4
[M+NH4]+ 225.109443 158.6
[M+K]+ 246.038778 150.9
[M+H-H2O]+ 190.072880 133.8
[M+HCOO]- 252.073821 164.1
[M+CH3COO]- 266.089471 186.7
[M+Na-2H]- 228.050286 149.5
[M]+ 207.07507142 145.5
[M]- 207.07616858 145.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.