CID 135537316

2-[(e)-[(e)-3-pyridylmethylenehydrazono]methyl]phenol

Structural Information

Molecular Formula
C13H11N3O
SMILES
C1=CC=C(C(=C1)/C=N/N=C/C2=CN=CC=C2)O
InChI
InChI=1S/C13H11N3O/c17-13-6-2-1-5-12(13)10-16-15-9-11-4-3-7-14-8-11/h1-10,17H/b15-9+,16-10+
InChIKey
XHGYDPORIMMMED-KAVGSWPWSA-N
Compound name
2-[(E)-[(E)-pyridin-3-ylmethylidenehydrazinylidene]methyl]phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

225.09021 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.09749 148.3
[M+Na]+ 248.07943 155.7
[M-H]- 224.08293 155.0
[M+NH4]+ 243.12403 164.9
[M+K]+ 264.05337 151.9
[M+H-H2O]+ 208.08747 139.3
[M+HCOO]- 270.08841 175.9
[M+CH3COO]- 284.10406 194.2
[M+Na-2H]- 246.06488 157.6
[M]+ 225.08966 148.2
[M]- 225.09076 148.2
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.