CID 23284095

Colorfix

Structural Information

Molecular Formula
C3H4N4O
SMILES
C(=O)N(C#N)C(=N)N
InChI
InChI=1S/C3H4N4O/c4-1-7(2-8)3(5)6/h2H,(H3,5,6)
InChIKey
RMUPNSINHUOUPL-UHFFFAOYSA-N
Compound name
N-carbamimidoyl-N-cyanoformamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

59
Patents

112.03851 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 113.04579 127.4
[M+Na]+ 135.02773 134.4
[M+NH4]+ 130.07233 130.6
[M+K]+ 151.00167 128.1
[M-H]- 111.03123 120.3
[M+Na-2H]- 133.01318 128.1
[M]+ 112.03796 125.0
[M]- 112.03906 125.0
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

patents stripe