CID 52084

Brn 2980971

Structural Information

Molecular Formula
C17H28N2O2
SMILES
CCCCOC1=CC=CC=C1C(=O)NCCN(CC)CC
InChI
InChI=1S/C17H28N2O2/c1-4-7-14-21-16-11-9-8-10-15(16)17(20)18-12-13-19(5-2)6-3/h8-11H,4-7,12-14H2,1-3H3,(H,18,20)
InChIKey
JPBSGNFLQPFAEW-UHFFFAOYSA-N
Compound name
2-butoxy-N-[2-(diethylamino)ethyl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

292.2151 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 293.222376 174.6
[M+Na]+ 315.204318 177.8
[M-H]- 291.207824 178.4
[M+NH4]+ 310.248923 190.1
[M+K]+ 331.178258 176.3
[M+H-H2O]+ 275.212360 166.3
[M+HCOO]- 337.213301 198.6
[M+CH3COO]- 351.228951 213.2
[M+Na-2H]- 313.189766 176.3
[M]+ 292.21455142 178.9
[M]- 292.21564858 178.9
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.