CID 15365

Dymanthine

Structural Information

Molecular Formula
C20H43N
SMILES
CCCCCCCCCCCCCCCCCCN(C)C
InChI
InChI=1S/C20H43N/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(2)3/h4-20H2,1-3H3
InChIKey
NAPSCFZYZVSQHF-UHFFFAOYSA-N
Compound name
N,N-dimethyloctadecan-1-amine
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

11
References

24065
Patents

297.33954 Da
Monoisotopic Mass

9.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 298.34682 187.1
[M+Na]+ 320.32876 187.8
[M-H]- 296.33226 186.1
[M+NH4]+ 315.37336 203.0
[M+K]+ 336.30270 185.2
[M+H-H2O]+ 280.33680 179.4
[M+HCOO]- 342.33774 207.7
[M+CH3COO]- 356.35339 217.9
[M+Na-2H]- 318.31421 186.0
[M]+ 297.33899 194.1
[M]- 297.34009 194.1
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