CID 57660

4-ethoxy-3,5-dipropylbenzamide

Structural Information

Molecular Formula
C15H23NO2
SMILES
CCCC1=CC(=CC(=C1OCC)CCC)C(=O)N
InChI
InChI=1S/C15H23NO2/c1-4-7-11-9-13(15(16)17)10-12(8-5-2)14(11)18-6-3/h9-10H,4-8H2,1-3H3,(H2,16,17)
InChIKey
UKTOQHCZCJDSOD-UHFFFAOYSA-N
Compound name
4-ethoxy-3,5-dipropylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

249.17288 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 250.180156 160.6
[M+Na]+ 272.162098 167.3
[M-H]- 248.165604 163.6
[M+NH4]+ 267.206703 177.9
[M+K]+ 288.136038 164.5
[M+H-H2O]+ 232.170140 153.9
[M+HCOO]- 294.171081 183.1
[M+CH3COO]- 308.186731 201.2
[M+Na-2H]- 270.147546 161.4
[M]+ 249.17233142 163.6
[M]- 249.17342858 163.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.