CID 535770

N'-cyanoethanimidamide

Structural Information

Molecular Formula
C3H5N3
SMILES
CC(=NC#N)N
InChI
InChI=1S/C3H5N3/c1-3(5)6-2-4/h1H3,(H2,5,6)
InChIKey
KKZFHAKALPLYLL-UHFFFAOYSA-N
Compound name
N'-cyanoethanimidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

115
Patents

83.04835 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 84.055626 115.8
[M+Na]+ 106.03757 124.6
[M-H]- 82.041074 117.7
[M+NH4]+ 101.08217 137.1
[M+K]+ 122.01151 125.4
[M+H-H2O]+ 66.045610 104.3
[M+HCOO]- 128.04655 138.7
[M+CH3COO]- 142.06220 183.6
[M+Na-2H]- 104.02302 122.6
[M]+ 83.047801 109.0
[M]- 83.048899 109.0
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