CID 62813

26635-92-7

Structural Information

Molecular Formula
C26H55NO4
SMILES
CCCCCCCCCCCCCCCCCCN(CCOCCO)CCOCCO
InChI
InChI=1S/C26H55NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-27(19-23-30-25-21-28)20-24-31-26-22-29/h28-29H,2-26H2,1H3
InChIKey
IEXQFYPEUSYMHN-UHFFFAOYSA-N
Compound name
2-[2-[2-(2-hydroxyethoxy)ethyl-octadecylamino]ethoxy]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

67
Patents

445.41312 Da
Monoisotopic Mass

7.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 446.42040 223.0
[M+Na]+ 468.40234 220.0
[M-H]- 444.40584 221.3
[M+NH4]+ 463.44694 231.5
[M+K]+ 484.37628 216.3
[M+H-H2O]+ 428.41038 213.8
[M+HCOO]- 490.41132 241.2
[M+CH3COO]- 504.42697 237.4
[M+Na-2H]- 466.38779 218.3
[M]+ 445.41257 232.6
[M]- 445.41367 232.6
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