CID 3043931

Propanamide, n-(4-(acetyloxy)phenyl)-2-(4-chlorophenoxy)-2-methyl-

Structural Information

Molecular Formula
C18H18ClNO4
SMILES
CC(=O)OC1=CC=C(C=C1)NC(=O)C(C)(C)OC2=CC=C(C=C2)Cl
InChI
InChI=1S/C18H18ClNO4/c1-12(21)23-15-10-6-14(7-11-15)20-17(22)18(2,3)24-16-8-4-13(19)5-9-16/h4-11H,1-3H3,(H,20,22)
InChIKey
QNQGUZROINIDPO-UHFFFAOYSA-N
Compound name
[4-[[2-(4-chlorophenoxy)-2-methylpropanoyl]amino]phenyl] acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

347.09244 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 348.09972 179.1
[M+Na]+ 370.08166 191.7
[M+NH4]+ 365.12626 185.5
[M+K]+ 386.05560 185.7
[M-H]- 346.08516 181.9
[M+Na-2H]- 368.06711 186.4
[M]+ 347.09189 181.9
[M]- 347.09299 181.9
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.