CID 50371

2-ethoxy-n-(1-phenylbutyl)benzamide

Structural Information

Molecular Formula
C19H23NO2
SMILES
CCCC(C1=CC=CC=C1)NC(=O)C2=CC=CC=C2OCC
InChI
InChI=1S/C19H23NO2/c1-3-10-17(15-11-6-5-7-12-15)20-19(21)16-13-8-9-14-18(16)22-4-2/h5-9,11-14,17H,3-4,10H2,1-2H3,(H,20,21)
InChIKey
MNRKBYBXKTZZLG-UHFFFAOYSA-N
Compound name
2-ethoxy-N-(1-phenylbutyl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

297.17288 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 298.18016 173.1
[M+Na]+ 320.16210 177.2
[M-H]- 296.16560 178.9
[M+NH4]+ 315.20670 187.5
[M+K]+ 336.13604 173.6
[M+H-H2O]+ 280.17014 164.5
[M+HCOO]- 342.17108 195.4
[M+CH3COO]- 356.18673 207.3
[M+Na-2H]- 318.14755 175.6
[M]+ 297.17233 174.4
[M]- 297.17343 174.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.