CID 6053548

327038-94-8

Structural Information

Molecular Formula
C20H17NO3
SMILES
COC1=CC=C(C=C1)NC(=O)/C=C/C2=CC=C(O2)C3=CC=CC=C3
InChI
InChI=1S/C20H17NO3/c1-23-17-9-7-16(8-10-17)21-20(22)14-12-18-11-13-19(24-18)15-5-3-2-4-6-15/h2-14H,1H3,(H,21,22)/b14-12+
InChIKey
KMYHCSMMFOACBL-WYMLVPIESA-N
Compound name
(E)-N-(4-methoxyphenyl)-3-(5-phenylfuran-2-yl)prop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

319.12085 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 320.12813 175.8
[M+Na]+ 342.11007 182.3
[M-H]- 318.11357 186.4
[M+NH4]+ 337.15467 189.7
[M+K]+ 358.08401 178.6
[M+H-H2O]+ 302.11811 167.2
[M+HCOO]- 364.11905 200.4
[M+CH3COO]- 378.13470 207.2
[M+Na-2H]- 340.09552 178.9
[M]+ 319.12030 177.9
[M]- 319.12140 177.9
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.