CID 371860

Nsc646380

Structural Information

Molecular Formula
C18H14N4O4
SMILES
C1=CC=C(C(=C1)C(=O)N)NC(=O)C(=O)CC2=NC3=CC=CC=C3NC2=O
InChI
InChI=1S/C18H14N4O4/c19-16(24)10-5-1-2-6-11(10)21-18(26)15(23)9-14-17(25)22-13-8-4-3-7-12(13)20-14/h1-8H,9H2,(H2,19,24)(H,21,26)(H,22,25)
InChIKey
RNHSYZXBGWOANI-UHFFFAOYSA-N
Compound name
2-[[2-oxo-3-(3-oxo-4H-quinoxalin-2-yl)propanoyl]amino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

350.1015 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 351.10878 178.5
[M+Na]+ 373.09072 184.9
[M-H]- 349.09422 181.9
[M+NH4]+ 368.13532 187.4
[M+K]+ 389.06466 179.9
[M+H-H2O]+ 333.09876 168.7
[M+HCOO]- 395.09970 197.0
[M+CH3COO]- 409.11535 215.9
[M+Na-2H]- 371.07617 182.2
[M]+ 350.10095 176.7
[M]- 350.10205 176.7
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.