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]+ 100.05054 115.2
[M+Na]+ 122.03248 124.2
[M-H]- 98.035984 118.7
[M+NH4]+ 117.07708 136.6
[M+K]+ 138.00642 126.6
[M+H-H2O]+ 82.040520 103.2
[M+HCOO]- 144.04146 140.2
[M+CH3COO]- 158.05711 189.1
[M+Na-2H]- 120.01793 123.6
[M]+ 99.042711 112.4
[M]- 99.043809 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.