CID 470926

N-(2-carbamoylethyl)pyrazin-2-ylcarboxamide

Structural Information

Molecular Formula
C8H10N4O2
SMILES
C1=CN=C(C=N1)C(=O)NCCC(=O)N
InChI
InChI=1S/C8H10N4O2/c9-7(13)1-2-12-8(14)6-5-10-3-4-11-6/h3-5H,1-2H2,(H2,9,13)(H,12,14)
InChIKey
ZKENJLGFUDSKJQ-UHFFFAOYSA-N
Compound name
N-(3-amino-3-oxopropyl)pyrazine-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

194.08037 Da
Monoisotopic Mass

-1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.08765 140.9
[M+Na]+ 217.06959 147.0
[M-H]- 193.07309 141.3
[M+NH4]+ 212.11419 156.3
[M+K]+ 233.04353 145.4
[M+H-H2O]+ 177.07763 132.7
[M+HCOO]- 239.07857 163.5
[M+CH3COO]- 253.09422 186.3
[M+Na-2H]- 215.05504 147.1
[M]+ 194.07982 139.0
[M]- 194.08092 139.0
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.