CID 14146482

N-(4-benzoylphenyl)-2-propenamide

Structural Information

Molecular Formula
C16H13NO2
SMILES
C=CC(=O)NC1=CC=C(C=C1)C(=O)C2=CC=CC=C2
InChI
InChI=1S/C16H13NO2/c1-2-15(18)17-14-10-8-13(9-11-14)16(19)12-6-4-3-5-7-12/h2-11H,1H2,(H,17,18)
InChIKey
OJMGRWMGCRBVGD-UHFFFAOYSA-N
Compound name
N-(4-benzoylphenyl)prop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

115
Patents

251.09464 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 252.10192 156.7
[M+Na]+ 274.08386 162.8
[M-H]- 250.08736 163.3
[M+NH4]+ 269.12846 172.9
[M+K]+ 290.05780 158.7
[M+H-H2O]+ 234.09190 148.9
[M+HCOO]- 296.09284 180.5
[M+CH3COO]- 310.10849 196.7
[M+Na-2H]- 272.06931 160.9
[M]+ 251.09409 155.6
[M]- 251.09519 155.6
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

patents stripe