CID 3074552

2-(cyanoimino)-n-formyl-1-pyrrolidineacetamide

Structural Information

Molecular Formula
C8H10N4O2
SMILES
C1CC(=NC#N)N(C1)CC(=O)NC=O
InChI
InChI=1S/C8H10N4O2/c9-5-10-7-2-1-3-12(7)4-8(14)11-6-13/h6H,1-4H2,(H,11,13,14)
InChIKey
CGRSCZSEEIETFF-UHFFFAOYSA-N
Compound name
2-(2-cyanoiminopyrrolidin-1-yl)-N-formylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

194.08037 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.087646 141.1
[M+Na]+ 217.069588 148.5
[M-H]- 193.073094 143.5
[M+NH4]+ 212.114193 158.4
[M+K]+ 233.043528 147.2
[M+H-H2O]+ 177.077630 126.8
[M+HCOO]- 239.078571 161.9
[M+CH3COO]- 253.094221 199.2
[M+Na-2H]- 215.055036 144.5
[M]+ 194.07982142 134.4
[M]- 194.08091858 134.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.