CID 3071435

N-(dibutylaminomethyl)valnoctamide hydrochloride

Structural Information

Molecular Formula
C17H36N2O
SMILES
CCCCN(CCCC)CNC(=O)C(CC)C(C)CC
InChI
InChI=1S/C17H36N2O/c1-6-10-12-19(13-11-7-2)14-18-17(20)16(9-4)15(5)8-3/h15-16H,6-14H2,1-5H3,(H,18,20)
InChIKey
DHLJPRYKXLBWGB-UHFFFAOYSA-N
Compound name
N-[(dibutylamino)methyl]-2-ethyl-3-methylpentanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

284.28278 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.29006 178.0
[M+Na]+ 307.27200 183.5
[M+NH4]+ 302.31660 183.5
[M+K]+ 323.24594 178.1
[M-H]- 283.27550 177.5
[M+Na-2H]- 305.25745 178.1
[M]+ 284.28223 178.2
[M]- 284.28333 178.2
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.