CID 76603

3147-53-3

Structural Information

Molecular Formula
C13H10N2O3
SMILES
C1=CC=C(C=C1)N=NC2=CC(=C(C=C2)O)C(=O)O
InChI
InChI=1S/C13H10N2O3/c16-12-7-6-10(8-11(12)13(17)18)15-14-9-4-2-1-3-5-9/h1-8,16H,(H,17,18)
InChIKey
JHDYSXXPQIFFJZ-UHFFFAOYSA-N
Compound name
2-hydroxy-5-phenyldiazenylbenzoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

145
Patents

242.06914 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.07642 152.7
[M+Na]+ 265.05836 165.4
[M+NH4]+ 260.10296 160.1
[M+K]+ 281.03230 159.2
[M-H]- 241.06186 157.2
[M+Na-2H]- 263.04381 161.6
[M]+ 242.06859 155.6
[M]- 242.06969 155.6
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

patents stripe