CID 198234

41859-57-8

Structural Information

Molecular Formula

C₁₅H₁₄ClNO₂

SMILES

C1=CC(=CC=C1CCNC(=O)C2=CC=C(C=C2)Cl)O

InChI

InChI=1S/C15H14ClNO2/c16-13-5-3-12(4-6-13)15(19)17-10-9-11-1-7-14(18)8-2-11/h1-8,18H,9-10H2,(H,17,19)

InChIKey

ZTLWJYCDAXUIBK-UHFFFAOYSA-N

Compound name

4-chloro-N-[2-(4-hydroxyphenyl)ethyl]benzamide

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 7
References: 30
Patents: 275.07132 Da
Monoisotopic Mass: 3.4
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]+	276.07860	161.7
[M+Na]+	298.06054	176.0
[M+NH4]+	293.10514	170.0
[M+K]+	314.03448	167.9
[M-H]-	274.06404	166.2
[M+Na-2H]-	296.04599	170.4
[M]+	275.07077	165.3
[M]-	275.07187	165.3

Literature stripe

literature stripe

Patent stripe

patents stripe