CID 6399078

3849-21-6

Structural Information

Molecular Formula
C5H6N2O3
SMILES
CCOC(=O)C(=NO)C#N
InChI
InChI=1S/C5H6N2O3/c1-2-10-5(8)4(3-6)7-9/h9H,2H2,1H3
InChIKey
LCFXLZAXGXOXAP-UHFFFAOYSA-N
Compound name
ethyl 2-cyano-2-hydroxyiminoacetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

8
References

4660
Patents

142.03784 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.04512 130.0
[M+Na]+ 165.02706 138.0
[M+NH4]+ 160.07166 132.9
[M+K]+ 181.00100 131.8
[M-H]- 141.03056 121.3
[M+Na-2H]- 163.01251 130.3
[M]+ 142.03729 127.4
[M]- 142.03839 127.4
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

patents stripe