CID 3066818

111325-84-9

Structural Information

Molecular Formula
C18H36N2O
SMILES
CCCCCCCC(C)(C)NC(=O)CN1CCCCC1C
InChI
InChI=1S/C18H36N2O/c1-5-6-7-8-10-13-18(3,4)19-17(21)15-20-14-11-9-12-16(20)2/h16H,5-15H2,1-4H3,(H,19,21)
InChIKey
UEKKYQGUDKJXMF-UHFFFAOYSA-N
Compound name
N-(2-methylnonan-2-yl)-2-(2-methylpiperidin-1-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

296.28278 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 297.290056 180.2
[M+Na]+ 319.271998 181.3
[M-H]- 295.275504 180.2
[M+NH4]+ 314.316603 194.0
[M+K]+ 335.245938 178.6
[M+H-H2O]+ 279.280040 172.5
[M+HCOO]- 341.280981 195.0
[M+CH3COO]- 355.296631 209.9
[M+Na-2H]- 317.257446 179.9
[M]+ 296.28223142 178.8
[M]- 296.28332858 178.8
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.