CID 5274053

2-hydroxy-4-methoxy-n-(3-nitrophenyl)benzamide

Structural Information

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

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

288.07462 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 289.08190 160.7
[M+Na]+ 311.06384 166.6
[M-H]- 287.06734 166.6
[M+NH4]+ 306.10844 174.1
[M+K]+ 327.03778 160.0
[M+H-H2O]+ 271.07188 157.3
[M+HCOO]- 333.07282 185.3
[M+CH3COO]- 347.08847 194.6
[M+Na-2H]- 309.04929 166.8
[M]+ 288.07407 159.9
[M]- 288.07517 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

literature stripe

Patent stripe

No patent data available for this compound.