CID 307892

Nsc206212

Structural Information

Molecular Formula
C14H10N2O5
SMILES
C1=CC=C(C(=C1)C(=O)O)N=NC2=CC(=C(C=C2)O)C(=O)O
InChI
InChI=1S/C14H10N2O5/c17-12-6-5-8(7-10(12)14(20)21)15-16-11-4-2-1-3-9(11)13(18)19/h1-7,17H,(H,18,19)(H,20,21)
InChIKey
BIMRBTZQYOQFBD-UHFFFAOYSA-N
Compound name
5-[(2-carboxyphenyl)diazenyl]-2-hydroxybenzoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

12
Patents

286.05896 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 287.06624 159.9
[M+Na]+ 309.04818 166.8
[M-H]- 285.05168 166.0
[M+NH4]+ 304.09278 173.8
[M+K]+ 325.02212 164.6
[M+H-H2O]+ 269.05622 151.9
[M+HCOO]- 331.05716 184.3
[M+CH3COO]- 345.07281 202.8
[M+Na-2H]- 307.03363 163.9
[M]+ 286.05841 160.5
[M]- 286.05951 160.5
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.