CID 93203

Ethylnitrosocyanamide

Structural Information

Molecular Formula
C3H5N3O
SMILES
CCN(C#N)N=O
InChI
InChI=1S/C3H5N3O/c1-2-6(3-4)5-7/h2H2,1H3
InChIKey
LMIMSGCBKHFTDY-UHFFFAOYSA-N
Compound name
ethyl(nitroso)cyanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

99.04326 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 100.050536 115.2
[M+Na]+ 122.032478 124.2
[M-H]- 98.035984 118.7
[M+NH4]+ 117.077083 136.6
[M+K]+ 138.006418 126.6
[M+H-H2O]+ 82.040520 103.2
[M+HCOO]- 144.041461 140.2
[M+CH3COO]- 158.057111 189.1
[M+Na-2H]- 120.017926 123.6
[M]+ 99.04271142 112.4
[M]- 99.04380858 112.4
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

No patent data available for this compound.