CID 135508900

N-hydroxy-6-[1,2,4]triazol-1-yl-pyrazine-2-carboxamidine

Structural Information

Molecular Formula
C7H7N7O
SMILES
C1=C(N=C(C=N1)N2C=NC=N2)/C(=N\O)/N
InChI
InChI=1S/C7H7N7O/c8-7(13-15)5-1-9-2-6(12-5)14-4-10-3-11-14/h1-4,15H,(H2,8,13)
InChIKey
UYDAAUNOATXLRC-UHFFFAOYSA-N
Compound name
N'-hydroxy-6-(1,2,4-triazol-1-yl)pyrazine-2-carboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

205.07121 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.07849 141.3
[M+Na]+ 228.06043 150.2
[M-H]- 204.06393 142.0
[M+NH4]+ 223.10503 154.1
[M+K]+ 244.03437 147.1
[M+H-H2O]+ 188.06847 130.9
[M+HCOO]- 250.06941 163.0
[M+CH3COO]- 264.08506 152.9
[M+Na-2H]- 226.04588 148.8
[M]+ 205.07066 139.3
[M]- 205.07176 139.3
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

No patent data available for this compound.