CID 135418366

402934-69-4

Structural Information

Molecular Formula
C15H12N2O5
SMILES
C1=CC(=CC=C1CC(=O)O)N=NC2=CC(=C(C=C2)O)C(=O)O
InChI
InChI=1S/C15H12N2O5/c18-13-6-5-11(8-12(13)15(21)22)17-16-10-3-1-9(2-4-10)7-14(19)20/h1-6,8,18H,7H2,(H,19,20)(H,21,22)
InChIKey
FNRNBCNUWGWVFO-UHFFFAOYSA-N
Compound name
5-[[4-(carboxymethyl)phenyl]diazenyl]-2-hydroxybenzoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

176
Patents

300.07462 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 301.08190 164.4
[M+Na]+ 323.06384 170.8
[M-H]- 299.06734 170.4
[M+NH4]+ 318.10844 177.8
[M+K]+ 339.03778 168.4
[M+H-H2O]+ 283.07188 156.2
[M+HCOO]- 345.07282 188.5
[M+CH3COO]- 359.08847 205.8
[M+Na-2H]- 321.04929 167.9
[M]+ 300.07407 165.4
[M]- 300.07517 165.4
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.