CID 135400567

Salicylaldehyde azine

Structural Information

Molecular Formula

C₁₄H₁₂N₂O₂

SMILES

C1=CC=C(C(=C1)/C=N/N=C/C2=CC=CC=C2O)O

InChI

InChI=1S/C14H12N2O2/c17-13-7-3-1-5-11(13)9-15-16-10-12-6-2-4-8-14(12)18/h1-10,17-18H/b15-9+,16-10+

InChIKey

STOVYWBRBMYHPC-KAVGSWPWSA-N

Compound name

2-[(E)-[(E)-(2-hydroxyphenyl)methylidenehydrazinylidene]methyl]phenol

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 2
References: 518
Patents: 240.08987 Da
Monoisotopic Mass: 2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	241.09715	151.8
[M+Na]+	263.07909	159.2
[M-H]-	239.08259	158.9
[M+NH4]+	258.12369	168.8
[M+K]+	279.05303	155.2
[M+H-H2O]+	223.08713	143.9
[M+HCOO]-	285.08807	179.1
[M+CH3COO]-	299.10372	195.4
[M+Na-2H]-	261.06454	159.3
[M]+	240.08932	151.6
[M]-	240.09042	151.6

Literature stripe

literature stripe

Patent stripe

patents stripe