CID 54085

78109-82-7

Structural Information

Molecular Formula
C18H28N2O3
SMILES
CCCCOC1=CC=CC=C1C(=O)NCCCN2CCOCC2
InChI
InChI=1S/C18H28N2O3/c1-2-3-13-23-17-8-5-4-7-16(17)18(21)19-9-6-10-20-11-14-22-15-12-20/h4-5,7-8H,2-3,6,9-15H2,1H3,(H,19,21)
InChIKey
RMCOVVOYWJIODN-UHFFFAOYSA-N
Compound name
2-butoxy-N-(3-morpholin-4-ylpropyl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

320.21 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 321.217276 179.9
[M+Na]+ 343.199218 181.6
[M-H]- 319.202724 183.8
[M+NH4]+ 338.243823 190.4
[M+K]+ 359.173158 179.6
[M+H-H2O]+ 303.207260 170.0
[M+HCOO]- 365.208201 197.1
[M+CH3COO]- 379.223851 209.3
[M+Na-2H]- 341.184666 182.1
[M]+ 320.20945142 179.6
[M]- 320.21054858 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

No literature data available for this compound.

Patent stripe

No patent data available for this compound.