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]+ 195.08765 141.1
[M+Na]+ 217.06959 148.5
[M-H]- 193.07309 143.5
[M+NH4]+ 212.11419 158.4
[M+K]+ 233.04353 147.2
[M+H-H2O]+ 177.07763 126.8
[M+HCOO]- 239.07857 161.9
[M+CH3COO]- 253.09422 199.2
[M+Na-2H]- 215.05504 144.5
[M]+ 194.07982 134.4
[M]- 194.08092 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.