CID 45051334

3-(2-chloro-3-methoxyphenyl)-n-(2-methoxy-5-methylphenyl)-2-propenamide

Structural Information

Molecular Formula
C18H18ClNO3
SMILES
CC1=CC(=C(C=C1)OC)NC(=O)/C=C/C2=C(C(=CC=C2)OC)Cl
InChI
InChI=1S/C18H18ClNO3/c1-12-7-9-15(22-2)14(11-12)20-17(21)10-8-13-5-4-6-16(23-3)18(13)19/h4-11H,1-3H3,(H,20,21)/b10-8+
InChIKey
FXPXGBJBYBUWHZ-CSKARUKUSA-N
Compound name
(E)-3-(2-chloro-3-methoxyphenyl)-N-(2-methoxy-5-methylphenyl)prop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

331.09753 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 332.10481 176.5
[M+Na]+ 354.08675 191.1
[M+NH4]+ 349.13135 183.9
[M+K]+ 370.06069 182.8
[M-H]- 330.09025 180.8
[M+Na-2H]- 352.07220 184.1
[M]+ 331.09698 180.1
[M]- 331.09808 180.1
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.