CID 3055385

Acetamide, n-benzyl-2-(dibutylamino)-, hydrochloride

Structural Information

Molecular Formula
C17H28N2O
SMILES
CCCCN(CCCC)CC(=O)NCC1=CC=CC=C1
InChI
InChI=1S/C17H28N2O/c1-3-5-12-19(13-6-4-2)15-17(20)18-14-16-10-8-7-9-11-16/h7-11H,3-6,12-15H2,1-2H3,(H,18,20)
InChIKey
KQVYAMCETWAYFB-UHFFFAOYSA-N
Compound name
N-benzyl-2-(dibutylamino)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

276.22015 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.22743 171.8
[M+Na]+ 299.20937 174.2
[M-H]- 275.21287 175.2
[M+NH4]+ 294.25397 187.7
[M+K]+ 315.18331 172.0
[M+H-H2O]+ 259.21741 163.5
[M+HCOO]- 321.21835 195.6
[M+CH3COO]- 335.23400 210.0
[M+Na-2H]- 297.19482 174.2
[M]+ 276.21960 174.3
[M]- 276.22070 174.3
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.