CID 3088395

Brn 5353526

Structural Information

Molecular Formula
C20H23N3O
SMILES
CN(C)CCCN1C2=CC=CC=C2N=C(C1=O)CC3=CC=CC=C3
InChI
InChI=1S/C20H23N3O/c1-22(2)13-8-14-23-19-12-7-6-11-17(19)21-18(20(23)24)15-16-9-4-3-5-10-16/h3-7,9-12H,8,13-15H2,1-2H3
InChIKey
YBKLKPCEEQYCSQ-UHFFFAOYSA-N
Compound name
3-benzyl-1-[3-(dimethylamino)propyl]quinoxalin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

321.1841 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 322.19138 178.8
[M+Na]+ 344.17332 186.3
[M-H]- 320.17682 184.6
[M+NH4]+ 339.21792 191.5
[M+K]+ 360.14726 181.0
[M+H-H2O]+ 304.18136 167.8
[M+HCOO]- 366.18230 199.9
[M+CH3COO]- 380.19795 215.9
[M+Na-2H]- 342.15877 184.3
[M]+ 321.18355 181.8
[M]- 321.18465 181.8
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.