CID 3548076

Dtxsid501366646

Structural Information

Molecular Formula
C19H39NO3
SMILES
CCCCCCCCCCCCCCN(CCO)C(=O)OCC
InChI
InChI=1S/C19H39NO3/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-20(17-18-21)19(22)23-4-2/h21H,3-18H2,1-2H3
InChIKey
TVUHJUIZGKVUOW-UHFFFAOYSA-N
Compound name
ethyl N-(2-hydroxyethyl)-N-tetradecylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

329.293 Da
Monoisotopic Mass

6.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 330.300276 191.1
[M+Na]+ 352.282218 191.9
[M-H]- 328.285724 189.0
[M+NH4]+ 347.326823 204.9
[M+K]+ 368.256158 190.1
[M+H-H2O]+ 312.290260 183.5
[M+HCOO]- 374.291201 210.6
[M+CH3COO]- 388.306851 216.3
[M+Na-2H]- 350.267666 189.0
[M]+ 329.29245142 198.7
[M]- 329.29354858 198.7
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.