CID 78583

4867-02-1

Structural Information

Molecular Formula
C12H10N2O3
SMILES
C1=CC=C(C(=C1)N=NC2=C(C=C(C=C2)O)O)O
InChI
InChI=1S/C12H10N2O3/c15-8-5-6-10(12(17)7-8)14-13-9-3-1-2-4-11(9)16/h1-7,15-17H
InChIKey
UYZDJWAAXREYDP-UHFFFAOYSA-N
Compound name
4-[(2-hydroxyphenyl)diazenyl]benzene-1,3-diol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

20
Patents

230.06914 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.07642 146.9
[M+Na]+ 253.05836 155.1
[M-H]- 229.06186 153.3
[M+NH4]+ 248.10296 163.7
[M+K]+ 269.03230 151.9
[M+H-H2O]+ 213.06640 139.5
[M+HCOO]- 275.06734 173.3
[M+CH3COO]- 289.08299 191.8
[M+Na-2H]- 251.04381 154.2
[M]+ 230.06859 146.7
[M]- 230.06969 146.7
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

patents stripe