CID 135426873

31253-48-2

Structural Information

Molecular Formula
C4H7N7O2
SMILES
C1(=NN=C(NC1=O)NN)C(=O)NN
InChI
InChI=1S/C4H7N7O2/c5-8-3(13)1-2(12)7-4(9-6)11-10-1/h5-6H2,(H,8,13)(H2,7,9,11,12)
InChIKey
LRRUHWFRVYONIN-UHFFFAOYSA-N
Compound name
3-hydrazinyl-5-oxo-4H-1,2,4-triazine-6-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

185.06612 Da
Monoisotopic Mass

-2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.07340 135.2
[M+Na]+ 208.05534 143.2
[M-H]- 184.05884 133.9
[M+NH4]+ 203.09994 148.7
[M+K]+ 224.02928 140.6
[M+H-H2O]+ 168.06338 126.8
[M+HCOO]- 230.06432 158.7
[M+CH3COO]- 244.07997 187.0
[M+Na-2H]- 206.04079 142.6
[M]+ 185.06557 129.6
[M]- 185.06667 129.6
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.