CID 3049209

64593-91-5

Structural Information

Molecular Formula

C₁₃H₁₂N₂O

SMILES

C1=CC=C(C=C1)C(=NC2=CC=C(C=C2)O)N

InChI

InChI=1S/C13H12N2O/c14-13(10-4-2-1-3-5-10)15-11-6-8-12(16)9-7-11/h1-9,16H,(H2,14,15)

InChIKey

UTUBFNWFHOTIHS-UHFFFAOYSA-N

Compound name

N'-(4-hydroxyphenyl)benzenecarboximidamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 11
Patents: 212.09496 Da
Monoisotopic Mass: 2.3
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]+	213.10224	145.9
[M+Na]+	235.08418	152.3
[M-H]-	211.08768	152.3
[M+NH4]+	230.12878	163.4
[M+K]+	251.05812	148.6
[M+H-H2O]+	195.09222	138.4
[M+HCOO]-	257.09316	171.6
[M+CH3COO]-	271.10881	190.8
[M+Na-2H]-	233.06963	152.4
[M]+	212.09441	142.7
[M]-	212.09551	142.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe