CID 710755

N-(2-ethoxyphenyl)-2-nitrobenzamide

Structural Information

Molecular Formula
C15H14N2O4
SMILES
CCOC1=CC=CC=C1NC(=O)C2=CC=CC=C2[N+](=O)[O-]
InChI
InChI=1S/C15H14N2O4/c1-2-21-14-10-6-4-8-12(14)16-15(18)11-7-3-5-9-13(11)17(19)20/h3-10H,2H2,1H3,(H,16,18)
InChIKey
FBZPDJOSGMQYCQ-UHFFFAOYSA-N
Compound name
N-(2-ethoxyphenyl)-2-nitrobenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

286.09537 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 287.10265 163.2
[M+Na]+ 309.08459 168.4
[M-H]- 285.08809 169.9
[M+NH4]+ 304.12919 177.2
[M+K]+ 325.05853 161.7
[M+H-H2O]+ 269.09263 159.4
[M+HCOO]- 331.09357 188.8
[M+CH3COO]- 345.10922 196.8
[M+Na-2H]- 307.07004 169.6
[M]+ 286.09482 162.8
[M]- 286.09592 162.8
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.