CID 54037118

N-phenethyl-n-phenylpropionamide

Structural Information

Molecular Formula
C17H19NO
SMILES
CCC(=O)N(CCC1=CC=CC=C1)C2=CC=CC=C2
InChI
InChI=1S/C17H19NO/c1-2-17(19)18(16-11-7-4-8-12-16)14-13-15-9-5-3-6-10-15/h3-12H,2,13-14H2,1H3
InChIKey
UDBQSKYSXWJXRB-UHFFFAOYSA-N
Compound name
N-phenyl-N-(2-phenylethyl)propanamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

2
Patents

253.14667 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 254.153946 160.7
[M+Na]+ 276.135888 165.3
[M-H]- 252.139394 167.9
[M+NH4]+ 271.180493 177.4
[M+K]+ 292.109828 162.4
[M+H-H2O]+ 236.143930 152.2
[M+HCOO]- 298.144871 185.0
[M+CH3COO]- 312.160521 200.7
[M+Na-2H]- 274.121336 165.4
[M]+ 253.14612142 161.3
[M]- 253.14721858 161.3
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.