CID 64876

N-benzyl-3-(4-methoxyphenyl)propanamide

Structural Information

Molecular Formula
C17H19NO2
SMILES
COC1=CC=C(C=C1)CCC(=O)NCC2=CC=CC=C2
InChI
InChI=1S/C17H19NO2/c1-20-16-10-7-14(8-11-16)9-12-17(19)18-13-15-5-3-2-4-6-15/h2-8,10-11H,9,12-13H2,1H3,(H,18,19)
InChIKey
YZQICPWATBOPQD-UHFFFAOYSA-N
Compound name
N-benzyl-3-(4-methoxyphenyl)propanamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

16
Patents

269.14157 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.14885 164.6
[M+Na]+ 292.13079 177.8
[M+NH4]+ 287.17539 172.7
[M+K]+ 308.10473 169.6
[M-H]- 268.13429 169.5
[M+Na-2H]- 290.11624 173.6
[M]+ 269.14102 167.9
[M]- 269.14212 167.9
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

patents stripe