CID 62109

7651-02-7

Structural Information

Molecular Formula
C23H48N2O
SMILES
CCCCCCCCCCCCCCCCCC(=O)NCCCN(C)C
InChI
InChI=1S/C23H48N2O/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-23(26)24-21-19-22-25(2)3/h4-22H2,1-3H3,(H,24,26)
InChIKey
WWVIUVHFPSALDO-UHFFFAOYSA-N
Compound name
N-[3-(dimethylamino)propyl]octadecanamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

3
References

14434
Patents

368.37668 Da
Monoisotopic Mass

8.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 369.38396 203.4
[M+Na]+ 391.36590 208.4
[M+NH4]+ 386.41050 208.1
[M+K]+ 407.33984 199.9
[M-H]- 367.36940 203.1
[M+Na-2H]- 389.35135 202.8
[M]+ 368.37613 203.6
[M]- 368.37723 203.6
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