CID 853839

4-chloro-2',6'-diethylbenzanilide

Structural Information

Molecular Formula
C17H18ClNO
SMILES
CCC1=C(C(=CC=C1)CC)NC(=O)C2=CC=C(C=C2)Cl
InChI
InChI=1S/C17H18ClNO/c1-3-12-6-5-7-13(4-2)16(12)19-17(20)14-8-10-15(18)11-9-14/h5-11H,3-4H2,1-2H3,(H,19,20)
InChIKey
OKHWQTNWIVVERA-UHFFFAOYSA-N
Compound name
4-chloro-N-(2,6-diethylphenyl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

287.1077 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 288.11498 167.2
[M+Na]+ 310.09692 182.6
[M+NH4]+ 305.14152 176.2
[M+K]+ 326.07086 173.3
[M-H]- 286.10042 172.7
[M+Na-2H]- 308.08237 176.3
[M]+ 287.10715 171.4
[M]- 287.10825 171.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.