CID 105306

Einecs 266-199-3

Structural Information

Molecular Formula
C21H44N2O3
SMILES
CCCCCCCCCCCCCC(=O)NCCCN(CCO)CCO
InChI
InChI=1S/C21H44N2O3/c1-2-3-4-5-6-7-8-9-10-11-12-14-21(26)22-15-13-16-23(17-19-24)18-20-25/h24-25H,2-20H2,1H3,(H,22,26)
InChIKey
VNRVRVIRWRSXJY-UHFFFAOYSA-N
Compound name
N-[3-[bis(2-hydroxyethyl)amino]propyl]tetradecanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

372.3352 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 373.34248 202.0
[M+Na]+ 395.32442 200.5
[M-H]- 371.32792 197.9
[M+NH4]+ 390.36902 212.8
[M+K]+ 411.29836 197.4
[M+H-H2O]+ 355.33246 193.6
[M+HCOO]- 417.33340 220.3
[M+CH3COO]- 431.34905 225.4
[M+Na-2H]- 393.30987 198.8
[M]+ 372.33465 207.6
[M]- 372.33575 207.6
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.