CID 5471458

Dtxsid801164027

Structural Information

Molecular Formula
C19H21NO3
SMILES
COC1=CC=C(C=C1)C(CNC(=O)/C=C/C2=CC=CC=C2)OC
InChI
InChI=1S/C19H21NO3/c1-22-17-11-9-16(10-12-17)18(23-2)14-20-19(21)13-8-15-6-4-3-5-7-15/h3-13,18H,14H2,1-2H3,(H,20,21)/b13-8+
InChIKey
PJIOBHFHQZPYOX-MDWZMJQESA-N
Compound name
(E)-N-[2-methoxy-2-(4-methoxyphenyl)ethyl]-3-phenylprop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

311.15213 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 312.15941 175.2
[M+Na]+ 334.14135 179.6
[M-H]- 310.14485 181.1
[M+NH4]+ 329.18595 189.0
[M+K]+ 350.11529 176.0
[M+H-H2O]+ 294.14939 166.4
[M+HCOO]- 356.15033 197.9
[M+CH3COO]- 370.16598 207.9
[M+Na-2H]- 332.12680 177.8
[M]+ 311.15158 177.1
[M]- 311.15268 177.1
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.