CID 112353

N-octyldodecanamide

Structural Information

Molecular Formula
C20H41NO
SMILES
CCCCCCCCCCCC(=O)NCCCCCCCC
InChI
InChI=1S/C20H41NO/c1-3-5-7-9-11-12-13-14-16-18-20(22)21-19-17-15-10-8-6-4-2/h3-19H2,1-2H3,(H,21,22)
InChIKey
NBEJBMSIQHPHDT-UHFFFAOYSA-N
Compound name
N-octyldodecanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

138
Patents

311.31882 Da
Monoisotopic Mass

8.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 312.32610 188.8
[M+Na]+ 334.30804 189.5
[M-H]- 310.31154 186.5
[M+NH4]+ 329.35264 203.5
[M+K]+ 350.28198 185.8
[M+H-H2O]+ 294.31608 181.3
[M+HCOO]- 356.31702 208.4
[M+CH3COO]- 370.33267 215.4
[M+Na-2H]- 332.29349 187.3
[M]+ 311.31827 194.6
[M]- 311.31937 194.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe