CID 22051740

Octapropylene glycol

Structural Information

Molecular Formula
C24H50O9
SMILES
CC(CO)OCC(C)OCC(C)OCC(C)OCC(C)OCC(C)OCC(C)OCC(C)O
InChI
InChI=1S/C24H50O9/c1-17(26)10-27-19(3)12-29-21(5)14-31-23(7)16-33-24(8)15-32-22(6)13-30-20(4)11-28-18(2)9-25/h17-26H,9-16H2,1-8H3
InChIKey
ZZEANNAZZVVPKU-UHFFFAOYSA-N
Compound name
2-[2-[2-[2-[2-[2-[2-(2-hydroxypropoxy)propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2181
Patents

482.3455 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 483.35278 228.8
[M+Na]+ 505.33472 233.3
[M-H]- 481.33822 226.8
[M+NH4]+ 500.37932 238.7
[M+K]+ 521.30866 233.4
[M+H-H2O]+ 465.34276 232.2
[M+HCOO]- 527.34370 220.0
[M+CH3COO]- 541.35935 239.5
[M+Na-2H]- 503.32017 217.2
[M]+ 482.34495 229.3
[M]- 482.34605 229.3
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