CID 204882

1,3-propanediol, 2-(n-ethyl-n-tetradecylamino)-2-methyl-, hydrochloride

Structural Information

Molecular Formula
C20H43NO2
SMILES
CCCCCCCCCCCCCCN(CC)C(C)(CO)CO
InChI
InChI=1S/C20H43NO2/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-21(5-2)20(3,18-22)19-23/h22-23H,4-19H2,1-3H3
InChIKey
IDRJLCDTCKAKHQ-UHFFFAOYSA-N
Compound name
2-[ethyl(tetradecyl)amino]-2-methylpropane-1,3-diol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

329.32938 Da
Monoisotopic Mass

6.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 330.33666 190.2
[M+Na]+ 352.31860 195.4
[M+NH4]+ 347.36320 194.8
[M+K]+ 368.29254 189.0
[M-H]- 328.32210 188.0
[M+Na-2H]- 350.30405 189.4
[M]+ 329.32883 189.9
[M]- 329.32993 189.9
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

patents stripe