CID 114570919

2137774-41-3

Structural Information

Molecular Formula
C8H12N4O
SMILES
C1CN(CC1N)C2=NC=CNC2=O
InChI
InChI=1S/C8H12N4O/c9-6-1-4-12(5-6)7-8(13)11-3-2-10-7/h2-3,6H,1,4-5,9H2,(H,11,13)
InChIKey
VMJCDHRUHCFCCP-UHFFFAOYSA-N
Compound name
3-(3-aminopyrrolidin-1-yl)-1H-pyrazin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

180.1011 Da
Monoisotopic Mass

-1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 181.10838 138.1
[M+Na]+ 203.09032 148.8
[M+NH4]+ 198.13492 144.8
[M+K]+ 219.06426 145.8
[M-H]- 179.09382 139.3
[M+Na-2H]- 201.07577 143.8
[M]+ 180.10055 139.5
[M]- 180.10165 139.5
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.