CID 75023

2109-45-7

Structural Information

Molecular Formula

C₁₅H₁₅ClN₂O

SMILES

C1=CC=C(C=C1)C(=NCCO)C2=C(C=CC(=C2)Cl)N

InChI

InChI=1S/C15H15ClN2O/c16-12-6-7-14(17)13(10-12)15(18-8-9-19)11-4-2-1-3-5-11/h1-7,10,19H,8-9,17H2

InChIKey

DRRPSTDRWJZCBV-UHFFFAOYSA-N

Compound name

2-[[(2-amino-5-chlorophenyl)-phenylmethylidene]amino]ethanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 274.08728 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]+	275.094556	162.7
[M+Na]+	297.076498	169.9
[M-H]-	273.080004	168.8
[M+NH4]+	292.121103	178.8
[M+K]+	313.050438	163.9
[M+H-H2O]+	257.084540	155.6
[M+HCOO]-	319.085481	183.0
[M+CH3COO]-	333.101131	201.7
[M+Na-2H]-	295.061946	166.6
[M]+	274.08673142	162.8
[M]-	274.08782858	162.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe