CID 78224

N-(aminoiminomethyl)formamide

Structural Information

Molecular Formula
C2H5N3O
SMILES
C(=O)N=C(N)N
InChI
InChI=1S/C2H5N3O/c3-2(4)5-1-6/h1H,(H4,3,4,5,6)
InChIKey
XEBPBJPZBUSUEO-UHFFFAOYSA-N
Compound name
N-(diaminomethylidene)formamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

645
Patents

87.04326 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 88.050536 113.1
[M+Na]+ 110.03248 120.2
[M-H]- 86.035984 114.4
[M+NH4]+ 105.07708 135.9
[M+K]+ 126.00642 120.8
[M+H-H2O]+ 70.040520 107.7
[M+HCOO]- 132.04146 141.0
[M+CH3COO]- 146.05711 171.2
[M+Na-2H]- 108.01793 119.9
[M]+ 87.042711 109.5
[M]- 87.043809 109.5
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