CID 9570222

N,n'-dicarbamoylformamidine

Structural Information

Molecular Formula
C3H6N4O2
SMILES
C(=N/C(=O)N)\NC(=O)N
InChI
InChI=1S/C3H6N4O2/c4-2(8)6-1-7-3(5)9/h1H,(H5,4,5,6,7,8,9)
InChIKey
JUMKGYUEKMFOGQ-UHFFFAOYSA-N
Compound name
(E)-(carbamoylamino)methylideneurea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

130.04907 Da
Monoisotopic Mass

-1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 131.05635 123.5
[M+Na]+ 153.03829 129.4
[M-H]- 129.04179 124.6
[M+NH4]+ 148.08289 144.0
[M+K]+ 169.01223 130.2
[M+H-H2O]+ 113.04633 117.2
[M+HCOO]- 175.04727 151.5
[M+CH3COO]- 189.06292 180.5
[M+Na-2H]- 151.02374 128.6
[M]+ 130.04852 119.3
[M]- 130.04962 119.3
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.