CID 2837875

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

Structural Information

Molecular Formula
C18H18N4O4
SMILES
CCOC1=CC=CC=C1NC(=O)CC2C(=O)NC3=CC=CC=C3N2N=O
InChI
InChI=1S/C18H18N4O4/c1-2-26-16-10-6-4-8-13(16)19-17(23)11-15-18(24)20-12-7-3-5-9-14(12)22(15)21-25/h3-10,15H,2,11H2,1H3,(H,19,23)(H,20,24)
InChIKey
YIANCSFSDVXWFE-UHFFFAOYSA-N
Compound name
N-(2-ethoxyphenyl)-2-(1-nitroso-3-oxo-2,4-dihydroquinoxalin-2-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

354.1328 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 355.14008 180.7
[M+Na]+ 377.12202 186.7
[M-H]- 353.12552 185.3
[M+NH4]+ 372.16662 190.8
[M+K]+ 393.09596 182.6
[M+H-H2O]+ 337.13006 170.2
[M+HCOO]- 399.13100 200.2
[M+CH3COO]- 413.14665 219.2
[M+Na-2H]- 375.10747 185.4
[M]+ 354.13225 181.1
[M]- 354.13335 181.1
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.