CID 6447499

3-(4-chlorophenyl)-n-(2-(4-methoxyphenyl)ethyl)-2-methyl-2-propenamide

Structural Information

Molecular Formula
C19H20ClNO2
SMILES
C/C(=C\C1=CC=C(C=C1)Cl)/C(=O)NCCC2=CC=C(C=C2)OC
InChI
InChI=1S/C19H20ClNO2/c1-14(13-16-3-7-17(20)8-4-16)19(22)21-12-11-15-5-9-18(23-2)10-6-15/h3-10,13H,11-12H2,1-2H3,(H,21,22)/b14-13+
InChIKey
FMTTZUUADYFDKN-BUHFOSPRSA-N
Compound name
(E)-3-(4-chlorophenyl)-N-[2-(4-methoxyphenyl)ethyl]-2-methylprop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

329.11826 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 330.12554 178.4
[M+Na]+ 352.10748 184.7
[M-H]- 328.11098 184.5
[M+NH4]+ 347.15208 192.8
[M+K]+ 368.08142 178.7
[M+H-H2O]+ 312.11552 170.9
[M+HCOO]- 374.11646 196.4
[M+CH3COO]- 388.13211 210.6
[M+Na-2H]- 350.09293 179.7
[M]+ 329.11771 181.7
[M]- 329.11881 181.7
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.