CID 23258

Olaflur

Structural Information

Molecular Formula
C27H58N2O3
SMILES
CCCCCCCCCCCCCCCCCCN(CCCN(CCO)CCO)CCO
InChI
InChI=1S/C27H58N2O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-28(22-25-30)20-18-21-29(23-26-31)24-27-32/h30-32H,2-27H2,1H3
InChIKey
KRZCNRGNPAESDC-UHFFFAOYSA-N
Compound name
2-[3-[bis(2-hydroxyethyl)amino]propyl-octadecylamino]ethanol
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

114
References

9167
Patents

458.44473 Da
Monoisotopic Mass

7.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 459.45201 226.7
[M+Na]+ 481.43395 247.9
[M+NH4]+ 476.47855 242.4
[M+K]+ 497.40789 243.4
[M-H]- 457.43745 231.4
[M+Na-2H]- 479.41940 223.0
[M]+ 458.44418 239.6
[M]- 458.44528 239.6
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

patents stripe