CID 59747

103387-97-9

Structural Information

Molecular Formula
C20H26N2O3
SMILES
C1=CC=C(C=C1)C(=O)NCCCCCOC2=CC=C(C=C2)NCCO
InChI
InChI=1S/C20H26N2O3/c23-15-14-21-18-9-11-19(12-10-18)25-16-6-2-5-13-22-20(24)17-7-3-1-4-8-17/h1,3-4,7-12,21,23H,2,5-6,13-16H2,(H,22,24)
InChIKey
CKEHBPXLKBXNMP-UHFFFAOYSA-N
Compound name
N-[5-[4-(2-hydroxyethylamino)phenoxy]pentyl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

342.19434 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 343.20162 182.5
[M+Na]+ 365.18356 184.8
[M-H]- 341.18706 186.4
[M+NH4]+ 360.22816 193.9
[M+K]+ 381.15750 180.4
[M+H-H2O]+ 325.19160 173.0
[M+HCOO]- 387.19254 205.1
[M+CH3COO]- 401.20819 214.2
[M+Na-2H]- 363.16901 185.9
[M]+ 342.19379 183.5
[M]- 342.19489 183.5
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.