CID 3264735

2'-hydroxy-4-methoxy-4'-nitrobenzanilide

Structural Information

Molecular Formula
C14H12N2O5
SMILES
COC1=CC=C(C=C1)C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])O
InChI
InChI=1S/C14H12N2O5/c1-21-11-5-2-9(3-6-11)14(18)15-12-7-4-10(16(19)20)8-13(12)17/h2-8,17H,1H3,(H,15,18)
InChIKey
QXMLFPVHCBHIJM-UHFFFAOYSA-N
Compound name
N-(2-hydroxy-4-nitrophenyl)-4-methoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

288.07462 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 289.081896 160.7
[M+Na]+ 311.063838 166.6
[M-H]- 287.067344 166.6
[M+NH4]+ 306.108443 174.1
[M+K]+ 327.037778 160.0
[M+H-H2O]+ 271.071880 157.3
[M+HCOO]- 333.072821 185.3
[M+CH3COO]- 347.088471 194.6
[M+Na-2H]- 309.049286 166.8
[M]+ 288.07407142 159.9
[M]- 288.07516858 159.9
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.