CID 219241

Benzamide, n,n'-1,6-hexanediylbis-

Structural Information

Molecular Formula
C20H24N2O2
SMILES
C1=CC=C(C=C1)C(=O)NCCCCCCNC(=O)C2=CC=CC=C2
InChI
InChI=1S/C20H24N2O2/c23-19(17-11-5-3-6-12-17)21-15-9-1-2-10-16-22-20(24)18-13-7-4-8-14-18/h3-8,11-14H,1-2,9-10,15-16H2,(H,21,23)(H,22,24)
InChIKey
DYEBQBWYGSPVPH-UHFFFAOYSA-N
Compound name
N-(6-benzamidohexyl)benzamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

2
References

27
Patents

324.18378 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 325.19106 179.9
[M+Na]+ 347.17300 182.0
[M-H]- 323.17650 185.1
[M+NH4]+ 342.21760 192.5
[M+K]+ 363.14694 177.6
[M+H-H2O]+ 307.18104 170.5
[M+HCOO]- 369.18198 203.1
[M+CH3COO]- 383.19763 212.7
[M+Na-2H]- 345.15845 183.1
[M]+ 324.18323 179.6
[M]- 324.18433 179.6
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

patents stripe