CID 731501

2',6'-diethyl-2-methylbenzanilide

Structural Information

Molecular Formula
C18H21NO
SMILES
CCC1=C(C(=CC=C1)CC)NC(=O)C2=CC=CC=C2C
InChI
InChI=1S/C18H21NO/c1-4-14-10-8-11-15(5-2)17(14)19-18(20)16-12-7-6-9-13(16)3/h6-12H,4-5H2,1-3H3,(H,19,20)
InChIKey
LXVZFKVHYVRMFL-UHFFFAOYSA-N
Compound name
N-(2,6-diethylphenyl)-2-methylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

267.16232 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 268.16960 164.2
[M+Na]+ 290.15154 171.2
[M-H]- 266.15504 171.1
[M+NH4]+ 285.19614 180.8
[M+K]+ 306.12548 166.8
[M+H-H2O]+ 250.15958 156.5
[M+HCOO]- 312.16052 187.7
[M+CH3COO]- 326.17617 203.7
[M+Na-2H]- 288.13699 167.1
[M]+ 267.16177 165.2
[M]- 267.16287 165.2
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.