CID 39650

50341-80-5

Structural Information

Molecular Formula
C19H28N2O2
SMILES
CCCCN(CCN(CC)CC)C(=O)C1=CC2=CC=CC=C2O1
InChI
InChI=1S/C19H28N2O2/c1-4-7-12-21(14-13-20(5-2)6-3)19(22)18-15-16-10-8-9-11-17(16)23-18/h8-11,15H,4-7,12-14H2,1-3H3
InChIKey
CSZIMDXHTMNLDI-UHFFFAOYSA-N
Compound name
N-butyl-N-[2-(diethylamino)ethyl]-1-benzofuran-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

316.2151 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 317.222376 182.4
[M+Na]+ 339.204318 187.2
[M-H]- 315.207824 189.6
[M+NH4]+ 334.248923 199.1
[M+K]+ 355.178258 186.6
[M+H-H2O]+ 299.212360 174.2
[M+HCOO]- 361.213301 207.3
[M+CH3COO]- 375.228951 219.6
[M+Na-2H]- 337.189766 184.8
[M]+ 316.21455142 190.2
[M]- 316.21564858 190.2
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.