CID 3118629

317814-59-8

Structural Information

Molecular Formula
C18H19N3O2
SMILES
CC1=CC(=C(C=C1)NC(=O)CC2C(=O)NC3=CC=CC=C3N2)C
InChI
InChI=1S/C18H19N3O2/c1-11-7-8-13(12(2)9-11)20-17(22)10-16-18(23)21-15-6-4-3-5-14(15)19-16/h3-9,16,19H,10H2,1-2H3,(H,20,22)(H,21,23)
InChIKey
JPRPRHDGSSTJCT-UHFFFAOYSA-N
Compound name
N-(2,4-dimethylphenyl)-2-(3-oxo-2,4-dihydro-1H-quinoxalin-2-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

309.14774 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 310.155016 174.2
[M+Na]+ 332.136958 180.6
[M-H]- 308.140464 176.2
[M+NH4]+ 327.181563 185.5
[M+K]+ 348.110898 173.9
[M+H-H2O]+ 292.145000 165.1
[M+HCOO]- 354.145941 189.2
[M+CH3COO]- 368.161591 205.6
[M+Na-2H]- 330.122406 177.0
[M]+ 309.14719142 169.6
[M]- 309.14828858 169.6
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.