CID 135537318

3-[(e)-[(e)-2-pyridylmethylenehydrazono]methyl]benzene-1,2-diol

Structural Information

Molecular Formula
C13H11N3O2
SMILES
C1=CC=NC(=C1)/C=N/N=C/C2=C(C(=CC=C2)O)O
InChI
InChI=1S/C13H11N3O2/c17-12-6-3-4-10(13(12)18)8-15-16-9-11-5-1-2-7-14-11/h1-9,17-18H/b15-8+,16-9+
InChIKey
ZBWSFEITPWUQQN-BVXMOGEKSA-N
Compound name
3-[(E)-[(E)-pyridin-2-ylmethylidenehydrazinylidene]methyl]benzene-1,2-diol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

241.08513 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.092406 151.9
[M+Na]+ 264.074348 159.7
[M-H]- 240.077854 157.7
[M+NH4]+ 259.118953 167.4
[M+K]+ 280.048288 155.6
[M+H-H2O]+ 224.082390 143.2
[M+HCOO]- 286.083331 178.2
[M+CH3COO]- 300.098981 195.0
[M+Na-2H]- 262.059796 160.0
[M]+ 241.08458142 151.7
[M]- 241.08567858 151.7
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

No patent data available for this compound.