CID 60694

119299-66-0

Structural Information

Molecular Formula
C21H28N2O3
SMILES
COCCNC1=CC=C(C=C1)OCCCCCNC(=O)C2=CC=CC=C2
InChI
InChI=1S/C21H28N2O3/c1-25-17-15-22-19-10-12-20(13-11-19)26-16-7-3-6-14-23-21(24)18-8-4-2-5-9-18/h2,4-5,8-13,22H,3,6-7,14-17H2,1H3,(H,23,24)
InChIKey
LXJSNTGEECHGAJ-UHFFFAOYSA-N
Compound name
N-[5-[4-(2-methoxyethylamino)phenoxy]pentyl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

356.21 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 357.21728 187.3
[M+Na]+ 379.19922 189.6
[M-H]- 355.20272 192.5
[M+NH4]+ 374.24382 198.8
[M+K]+ 395.17316 185.8
[M+H-H2O]+ 339.20726 177.3
[M+HCOO]- 401.20820 211.1
[M+CH3COO]- 415.22385 219.5
[M+Na-2H]- 377.18467 190.5
[M]+ 356.20945 190.5
[M]- 356.21055 190.5
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.