CID 203068

Benzanilide, 5-amino-2-(octyloxy)-

Structural Information

Molecular Formula
C21H28N2O2
SMILES
CCCCCCCCOC1=C(C=C(C=C1)N)C(=O)NC2=CC=CC=C2
InChI
InChI=1S/C21H28N2O2/c1-2-3-4-5-6-10-15-25-20-14-13-17(22)16-19(20)21(24)23-18-11-8-7-9-12-18/h7-9,11-14,16H,2-6,10,15,22H2,1H3,(H,23,24)
InChIKey
XBGVPEVCCRSTFW-UHFFFAOYSA-N
Compound name
5-amino-2-octoxy-N-phenylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

340.2151 Da
Monoisotopic Mass

5.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 341.222376 185.5
[M+Na]+ 363.204318 189.0
[M-H]- 339.207824 190.6
[M+NH4]+ 358.248923 197.9
[M+K]+ 379.178258 184.2
[M+H-H2O]+ 323.212360 176.1
[M+HCOO]- 385.213301 208.5
[M+CH3COO]- 399.228951 218.1
[M+Na-2H]- 361.189766 186.8
[M]+ 340.21455142 186.7
[M]- 340.21564858 186.7
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.