CID 269894

16975-91-0

Structural Information

Molecular Formula
C10H12N6O
SMILES
C1=CC=C(C=C1)CN2C(=C(N=N2)C(=O)NN)N
InChI
InChI=1S/C10H12N6O/c11-9-8(10(17)13-12)14-15-16(9)6-7-4-2-1-3-5-7/h1-5H,6,11-12H2,(H,13,17)
InChIKey
NOIGRTLRFHCZFU-UHFFFAOYSA-N
Compound name
5-amino-1-benzyltriazole-4-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

232.10725 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 233.11453 149.3
[M+Na]+ 255.09647 156.8
[M-H]- 231.09997 152.1
[M+NH4]+ 250.14107 163.5
[M+K]+ 271.07041 153.3
[M+H-H2O]+ 215.10451 139.7
[M+HCOO]- 277.10545 173.2
[M+CH3COO]- 291.12110 195.8
[M+Na-2H]- 253.08192 154.1
[M]+ 232.10670 146.1
[M]- 232.10780 146.1
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.