CID 19167555

N-(4-butylphenyl)-2-(2,5-dimethylphenoxy)acetamide

Structural Information

Molecular Formula
C20H25NO2
SMILES
CCCCC1=CC=C(C=C1)NC(=O)COC2=C(C=CC(=C2)C)C
InChI
InChI=1S/C20H25NO2/c1-4-5-6-17-9-11-18(12-10-17)21-20(22)14-23-19-13-15(2)7-8-16(19)3/h7-13H,4-6,14H2,1-3H3,(H,21,22)
InChIKey
FITLZUNZXVZHKF-UHFFFAOYSA-N
Compound name
N-(4-butylphenyl)-2-(2,5-dimethylphenoxy)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

311.18854 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 312.195816 176.9
[M+Na]+ 334.177758 182.8
[M-H]- 310.181264 183.3
[M+NH4]+ 329.222363 191.6
[M+K]+ 350.151698 178.6
[M+H-H2O]+ 294.185800 168.4
[M+HCOO]- 356.186741 199.9
[M+CH3COO]- 370.202391 211.8
[M+Na-2H]- 332.163206 178.7
[M]+ 311.18799142 180.0
[M]- 311.18908858 180.0
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.