CID 4178408

N-(4-hydroxyphenyl)-4-methylbenzamide

Structural Information

Molecular Formula
C14H13NO2
SMILES
CC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)O
InChI
InChI=1S/C14H13NO2/c1-10-2-4-11(5-3-10)14(17)15-12-6-8-13(16)9-7-12/h2-9,16H,1H3,(H,15,17)
InChIKey
GOMRVZGCGJBGPN-UHFFFAOYSA-N
Compound name
N-(4-hydroxyphenyl)-4-methylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

10
Patents

227.09464 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 228.101916 149.7
[M+Na]+ 250.083858 156.9
[M-H]- 226.087364 155.5
[M+NH4]+ 245.128463 166.8
[M+K]+ 266.057798 153.1
[M+H-H2O]+ 210.091900 142.6
[M+HCOO]- 272.092841 173.3
[M+CH3COO]- 286.108491 190.1
[M+Na-2H]- 248.069306 155.1
[M]+ 227.09409142 148.5
[M]- 227.09518858 148.5
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