CID 73554570

1823925-32-1

Structural Information

Molecular Formula
C6H6N4O
SMILES
C1=CN2C(=NC(=N2)CO)C=N1
InChI
InChI=1S/C6H6N4O/c11-4-5-8-6-3-7-1-2-10(6)9-5/h1-3,11H,4H2
InChIKey
ICIOKYRPCURHJB-UHFFFAOYSA-N
Compound name
[1,2,4]triazolo[1,5-a]pyrazin-2-ylmethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

150.05415 Da
Monoisotopic Mass

-1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 151.06143 127.1
[M+Na]+ 173.04337 138.9
[M-H]- 149.04687 125.9
[M+NH4]+ 168.08797 145.4
[M+K]+ 189.01731 135.9
[M+H-H2O]+ 133.05141 119.2
[M+HCOO]- 195.05235 148.2
[M+CH3COO]- 209.06800 140.8
[M+Na-2H]- 171.02882 137.1
[M]+ 150.05360 129.0
[M]- 150.05470 129.0
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

patents stripe