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]+ 250.18016 160.6
[M+Na]+ 272.16210 167.3
[M-H]- 248.16560 163.6
[M+NH4]+ 267.20670 177.9
[M+K]+ 288.13604 164.5
[M+H-H2O]+ 232.17014 153.9
[M+HCOO]- 294.17108 183.1
[M+CH3COO]- 308.18673 201.2
[M+Na-2H]- 270.14755 161.4
[M]+ 249.17233 163.6
[M]- 249.17343 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

No literature data available for this compound.

Patent stripe

No patent data available for this compound.