CID 33886

Acetanilide, 2-(p-butoxyphenoxy)-2'-chloro-n-(2-(diethylamino)ethyl)-

Structural Information

Molecular Formula
C24H33ClN2O3
SMILES
CCCCOC1=CC=C(C=C1)OCC(=O)N(CCN(CC)CC)C2=CC=CC=C2Cl
InChI
InChI=1S/C24H33ClN2O3/c1-4-7-18-29-20-12-14-21(15-13-20)30-19-24(28)27(17-16-26(5-2)6-3)23-11-9-8-10-22(23)25/h8-15H,4-7,16-19H2,1-3H3
InChIKey
MGBPTNFUZHRXSU-UHFFFAOYSA-N
Compound name
2-(4-butoxyphenoxy)-N-(2-chlorophenyl)-N-[2-(diethylamino)ethyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

432.21796 Da
Monoisotopic Mass

5.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 433.22524 209.5
[M+Na]+ 455.20718 212.6
[M-H]- 431.21068 217.3
[M+NH4]+ 450.25178 220.4
[M+K]+ 471.18112 209.1
[M+H-H2O]+ 415.21522 199.6
[M+HCOO]- 477.21616 228.7
[M+CH3COO]- 491.23181 239.4
[M+Na-2H]- 453.19263 208.3
[M]+ 432.21741 219.1
[M]- 432.21851 219.1
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.