CID 59354

Benzamide, n-(8-(p-aminophenoxy)octyl)-

Structural Information

Molecular Formula
C21H28N2O2
SMILES
C1=CC=C(C=C1)C(=O)NCCCCCCCCOC2=CC=C(C=C2)N
InChI
InChI=1S/C21H28N2O2/c22-19-12-14-20(15-13-19)25-17-9-4-2-1-3-8-16-23-21(24)18-10-6-5-7-11-18/h5-7,10-15H,1-4,8-9,16-17,22H2,(H,23,24)
InChIKey
AEGAJUJDRFAOLX-UHFFFAOYSA-N
Compound name
N-[8-(4-aminophenoxy)octyl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

340.2151 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 341.22238 185.0
[M+Na]+ 363.20432 187.5
[M-H]- 339.20782 189.6
[M+NH4]+ 358.24892 197.0
[M+K]+ 379.17826 182.6
[M+H-H2O]+ 323.21236 175.3
[M+HCOO]- 385.21330 207.9
[M+CH3COO]- 399.22895 216.9
[M+Na-2H]- 361.18977 187.1
[M]+ 340.21455 185.8
[M]- 340.21565 185.8
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

patents stripe