CID 4248894

2-(6,7-dimethyl-3-oxo-1,2,3,4-tetrahydroquinoxalin-2-yl)-n-(4-methoxyphenyl)acetamide

Structural Information

Molecular Formula
C19H21N3O3
SMILES
CC1=CC2=C(C=C1C)NC(=O)C(N2)CC(=O)NC3=CC=C(C=C3)OC
InChI
InChI=1S/C19H21N3O3/c1-11-8-15-16(9-12(11)2)22-19(24)17(21-15)10-18(23)20-13-4-6-14(25-3)7-5-13/h4-9,17,21H,10H2,1-3H3,(H,20,23)(H,22,24)
InChIKey
HREUAKZFKIEUSD-UHFFFAOYSA-N
Compound name
2-(6,7-dimethyl-3-oxo-2,4-dihydro-1H-quinoxalin-2-yl)-N-(4-methoxyphenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

339.1583 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 340.16558 182.0
[M+Na]+ 362.14752 188.6
[M-H]- 338.15102 184.2
[M+NH4]+ 357.19212 192.3
[M+K]+ 378.12146 182.5
[M+H-H2O]+ 322.15556 172.7
[M+HCOO]- 384.15650 196.7
[M+CH3COO]- 398.17215 212.2
[M+Na-2H]- 360.13297 183.7
[M]+ 339.15775 179.6
[M]- 339.15885 179.6
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.