CID 51340929

Amino-peg8-acid

Structural Information

Molecular Formula
C19H39NO10
SMILES
C(COCCOCCOCCOCCOCCOCCOCCOCCN)C(=O)O
InChI
InChI=1S/C19H39NO10/c20-2-4-24-6-8-26-10-12-28-14-16-30-18-17-29-15-13-27-11-9-25-7-5-23-3-1-19(21)22/h1-18,20H2,(H,21,22)
InChIKey
YLKOHZCQTVYVDB-UHFFFAOYSA-N
Compound name
3-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoic acid
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

265
Patents

441.2574 Da
Monoisotopic Mass

-4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 442.26468 219.5
[M+Na]+ 464.24662 221.9
[M+NH4]+ 459.29122 222.1
[M+K]+ 480.22056 219.8
[M-H]- 440.25012 211.9
[M+Na-2H]- 462.23207 223.3
[M]+ 441.25685 217.8
[M]- 441.25795 217.8
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