CID 3744049

2-(3-oxo-1,2,3,4-tetrahydroquinoxalin-2-yl)-n-(4-propoxyphenyl)acetamide

Structural Information

Molecular Formula
C19H21N3O3
SMILES
CCCOC1=CC=C(C=C1)NC(=O)CC2C(=O)NC3=CC=CC=C3N2
InChI
InChI=1S/C19H21N3O3/c1-2-11-25-14-9-7-13(8-10-14)20-18(23)12-17-19(24)22-16-6-4-3-5-15(16)21-17/h3-10,17,21H,2,11-12H2,1H3,(H,20,23)(H,22,24)
InChIKey
ARMQBGXTYQKAJS-UHFFFAOYSA-N
Compound name
2-(3-oxo-2,4-dihydro-1H-quinoxalin-2-yl)-N-(4-propoxyphenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

339.1583 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 340.165576 180.3
[M+Na]+ 362.147518 185.0
[M-H]- 338.151024 181.6
[M+NH4]+ 357.192123 189.9
[M+K]+ 378.121458 178.8
[M+H-H2O]+ 322.155560 170.5
[M+HCOO]- 384.156501 195.1
[M+CH3COO]- 398.172151 209.5
[M+Na-2H]- 360.132966 183.5
[M]+ 339.15775142 177.0
[M]- 339.15884858 177.0
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

No patent data available for this compound.