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

36
Patents

275.07132 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.07860 160.8
[M+Na]+ 298.06054 168.3
[M-H]- 274.06404 166.1
[M+NH4]+ 293.10514 176.8
[M+K]+ 314.03448 162.5
[M+H-H2O]+ 258.06858 154.2
[M+HCOO]- 320.06952 179.5
[M+CH3COO]- 334.08517 196.9
[M+Na-2H]- 296.04599 165.1
[M]+ 275.07077 162.2
[M]- 275.07187 162.2
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

patents stripe