CID 681288

(2e)-n-(2,5-dimethylphenyl)-3-phenylprop-2-enamide

Structural Information

Molecular Formula
C17H17NO
SMILES
CC1=CC(=C(C=C1)C)NC(=O)/C=C/C2=CC=CC=C2
InChI
InChI=1S/C17H17NO/c1-13-8-9-14(2)16(12-13)18-17(19)11-10-15-6-4-3-5-7-15/h3-12H,1-2H3,(H,18,19)/b11-10+
InChIKey
SUUINTFSMKCFPR-ZHACJKMWSA-N
Compound name
(E)-N-(2,5-dimethylphenyl)-3-phenylprop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

251.13101 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 252.13829 160.4
[M+Na]+ 274.12023 174.6
[M+NH4]+ 269.16483 168.9
[M+K]+ 290.09417 165.9
[M-H]- 250.12373 165.6
[M+Na-2H]- 272.10568 169.6
[M]+ 251.13046 163.9
[M]- 251.13156 163.9
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.