CID 6399032

(2z)-2-cyano-2-(hydroxyimino)acetamide

Structural Information

Molecular Formula
C3H3N3O2
SMILES
C(#N)/C(=N/O)/C(=O)N
InChI
InChI=1S/C3H3N3O2/c4-1-2(6-8)3(5)7/h8H,(H2,5,7)/b6-2-
InChIKey
CAFXGFHPOQBGJP-KXFIGUGUSA-N
Compound name
(2Z)-2-cyano-2-hydroxyiminoacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

177
Patents

113.02253 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 114.02981 122.7
[M+Na]+ 136.01175 130.9
[M-H]- 112.01525 123.3
[M+NH4]+ 131.05635 141.9
[M+K]+ 151.98569 131.8
[M+H-H2O]+ 96.019790 111.0
[M+HCOO]- 158.02073 143.8
[M+CH3COO]- 172.03638 185.0
[M+Na-2H]- 133.99720 127.5
[M]+ 113.02198 115.3
[M]- 113.02308 115.3
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