CID 62329626

1461714-27-1

Structural Information

Molecular Formula
C12H15N3O
SMILES
C1CNCC1N2CC(=O)NC3=CC=CC=C32
InChI
InChI=1S/C12H15N3O/c16-12-8-15(9-5-6-13-7-9)11-4-2-1-3-10(11)14-12/h1-4,9,13H,5-8H2,(H,14,16)
InChIKey
BOOUYUCGXHPCCS-UHFFFAOYSA-N
Compound name
4-pyrrolidin-3-yl-1,3-dihydroquinoxalin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

217.1215 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 218.12878 150.4
[M+Na]+ 240.11072 156.4
[M-H]- 216.11422 150.4
[M+NH4]+ 235.15532 165.8
[M+K]+ 256.08466 150.9
[M+H-H2O]+ 200.11876 141.7
[M+HCOO]- 262.11970 163.6
[M+CH3COO]- 276.13535 160.1
[M+Na-2H]- 238.09617 153.1
[M]+ 217.12095 142.0
[M]- 217.12205 142.0
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.