CID 73948

Carbohydrazide

Structural Information

Molecular Formula
CH6N4O
SMILES
C(=O)(NN)NN
InChI
InChI=1S/CH6N4O/c2-4-1(6)5-3/h2-3H2,(H2,4,5,6)
InChIKey
XEVRDFDBXJMZFG-UHFFFAOYSA-N
Compound name
1,3-diaminourea
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

177
References

19984
Patents

90.05416 Da
Monoisotopic Mass

-1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 91.061436 113.3
[M+Na]+ 113.04338 119.3
[M-H]- 89.046884 113.3
[M+NH4]+ 108.08798 134.9
[M+K]+ 129.01732 119.9
[M+H-H2O]+ 73.051420 107.6
[M+HCOO]- 135.05236 140.8
[M+CH3COO]- 149.06801 171.3
[M+Na-2H]- 111.02883 120.3
[M]+ 90.053611 107.2
[M]- 90.054709 107.2
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