CID 2834475

N-(2-methoxyphenyl)-2-(3-oxo-1,2,3,4-tetrahydroquinoxalin-2-yl)acetamide

Structural Information

Molecular Formula
C17H17N3O3
SMILES
COC1=CC=CC=C1NC(=O)CC2C(=O)NC3=CC=CC=C3N2
InChI
InChI=1S/C17H17N3O3/c1-23-15-9-5-4-8-13(15)19-16(21)10-14-17(22)20-12-7-3-2-6-11(12)18-14/h2-9,14,18H,10H2,1H3,(H,19,21)(H,20,22)
InChIKey
ADBJRYXMRWOLKF-UHFFFAOYSA-N
Compound name
N-(2-methoxyphenyl)-2-(3-oxo-2,4-dihydro-1H-quinoxalin-2-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

9
References

2
Patents

311.12698 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 312.13426 171.6
[M+Na]+ 334.11620 177.2
[M-H]- 310.11970 173.3
[M+NH4]+ 329.16080 182.4
[M+K]+ 350.09014 171.4
[M+H-H2O]+ 294.12424 162.2
[M+HCOO]- 356.12518 187.1
[M+CH3COO]- 370.14083 203.6
[M+Na-2H]- 332.10165 175.9
[M]+ 311.12643 167.6
[M]- 311.12753 167.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe