CID 53433575

756526-06-4

Structural Information

Molecular Formula
C23H47NO10
SMILES
CC(C)(C)OC(=O)CCOCCOCCOCCOCCOCCOCCOCCOCCN
InChI
InChI=1S/C23H47NO10/c1-23(2,3)34-22(25)4-6-26-8-10-28-12-14-30-16-18-32-20-21-33-19-17-31-15-13-29-11-9-27-7-5-24/h4-21,24H2,1-3H3
InChIKey
UMJVFHNJPJVDSB-UHFFFAOYSA-N
Compound name
tert-butyl 3-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

497.32 Da
Monoisotopic Mass

-1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 498.32728 228.2
[M+Na]+ 520.30922 230.4
[M+NH4]+ 515.35382 232.4
[M+K]+ 536.28316 228.3
[M-H]- 496.31272 220.0
[M+Na-2H]- 518.29467 231.4
[M]+ 497.31945 226.7
[M]- 497.32055 226.7
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

patents stripe