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]+ 355.140076 180.7
[M+Na]+ 377.122018 186.7
[M-H]- 353.125524 185.3
[M+NH4]+ 372.166623 190.8
[M+K]+ 393.095958 182.6
[M+H-H2O]+ 337.130060 170.2
[M+HCOO]- 399.131001 200.2
[M+CH3COO]- 413.146651 219.2
[M+Na-2H]- 375.107466 185.4
[M]+ 354.13225142 181.1
[M]- 354.13334858 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.