CID 77433

Malonic acid dihydrazide

Structural Information

Molecular Formula
C3H8N4O2
SMILES
C(C(=O)NN)C(=O)NN
InChI
InChI=1S/C3H8N4O2/c4-6-2(8)1-3(9)7-5/h1,4-5H2,(H,6,8)(H,7,9)
InChIKey
PSIKPHJLTVSQFO-UHFFFAOYSA-N
Compound name
propanedihydrazide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

3
References

2690
Patents

132.06473 Da
Monoisotopic Mass

-2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 133.07201 124.7
[M+Na]+ 155.05395 129.8
[M-H]- 131.05745 124.3
[M+NH4]+ 150.09855 144.4
[M+K]+ 171.02789 130.3
[M+H-H2O]+ 115.06199 118.4
[M+HCOO]- 177.06293 150.9
[M+CH3COO]- 191.07858 179.7
[M+Na-2H]- 153.03940 129.3
[M]+ 132.06418 119.4
[M]- 132.06528 119.4
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

patents stripe