CID 459048

O-(2-hydroxy-5-methoxyphenylazo)benzoic acid

Structural Information

Molecular Formula
C14H12N2O4
SMILES
COC1=CC(=C(C=C1)O)N=NC2=CC=CC=C2C(=O)O
InChI
InChI=1S/C14H12N2O4/c1-20-9-6-7-13(17)12(8-9)16-15-11-5-3-2-4-10(11)14(18)19/h2-8,17H,1H3,(H,18,19)
InChIKey
JYIBNTBVFMTDCQ-UHFFFAOYSA-N
Compound name
2-[(2-hydroxy-5-methoxyphenyl)diazenyl]benzoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

272.0797 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.08698 157.9
[M+Na]+ 295.06892 165.5
[M-H]- 271.07242 165.4
[M+NH4]+ 290.11352 173.5
[M+K]+ 311.04286 163.4
[M+H-H2O]+ 255.07696 149.7
[M+HCOO]- 317.07790 184.6
[M+CH3COO]- 331.09355 202.6
[M+Na-2H]- 293.05437 163.5
[M]+ 272.07915 160.3
[M]- 272.08025 160.3
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.