CID 2302649

2-bromo-n-(2-(4-propylphenoxy)ethyl)benzamide

Structural Information

Molecular Formula
C18H20BrNO2
SMILES
CCCC1=CC=C(C=C1)OCCNC(=O)C2=CC=CC=C2Br
InChI
InChI=1S/C18H20BrNO2/c1-2-5-14-8-10-15(11-9-14)22-13-12-20-18(21)16-6-3-4-7-17(16)19/h3-4,6-11H,2,5,12-13H2,1H3,(H,20,21)
InChIKey
SSLLBEVIPZZPJQ-UHFFFAOYSA-N
Compound name
2-bromo-N-[2-(4-propylphenoxy)ethyl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

361.06775 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 362.07503 176.4
[M+Na]+ 384.05697 180.1
[M+NH4]+ 379.10157 180.5
[M+K]+ 400.03091 178.1
[M-H]- 360.06047 179.2
[M+Na-2H]- 382.04242 181.0
[M]+ 361.06720 176.6
[M]- 361.06830 176.6
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.