CID 67321

139-92-4

Structural Information

Molecular Formula
C24H48N2O4
SMILES
CCCCCCCCCCCCCCCCCC(=O)NCCN(CCO)CC(=O)O
InChI
InChI=1S/C24H48N2O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23(28)25-18-19-26(20-21-27)22-24(29)30/h27H,2-22H2,1H3,(H,25,28)(H,29,30)
InChIKey
LNOVYKOGIVPBAI-UHFFFAOYSA-N
Compound name
2-[2-hydroxyethyl-[2-(octadecanoylamino)ethyl]amino]acetic acid
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

1037
Patents

428.36142 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 429.36870 214.7
[M+Na]+ 451.35064 235.9
[M+NH4]+ 446.39524 231.0
[M+K]+ 467.32458 231.3
[M-H]- 427.35414 222.7
[M+Na-2H]- 449.33609 210.8
[M]+ 428.36087 228.2
[M]- 428.36197 228.2
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.