CID 18282

3055-96-7

Structural Information

Molecular Formula
C24H50O7
SMILES
CCCCCCCCCCCCOCCOCCOCCOCCOCCOCCO
InChI
InChI=1S/C24H50O7/c1-2-3-4-5-6-7-8-9-10-11-13-26-15-17-28-19-21-30-23-24-31-22-20-29-18-16-27-14-12-25/h25H,2-24H2,1H3
InChIKey
OJCFEGKCRWEVSN-UHFFFAOYSA-N
Compound name
2-[2-[2-[2-[2-(2-dodecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanol
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

11
References

3372
Patents

450.35565 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 451.362926 225.0
[M+Na]+ 473.344868 227.7
[M-H]- 449.348374 210.3
[M+NH4]+ 468.389473 223.2
[M+K]+ 489.318808 223.5
[M+H-H2O]+ 433.352910 207.1
[M+HCOO]- 495.353851 236.7
[M+CH3COO]- 509.369501 231.3
[M+Na-2H]- 471.330316 210.1
[M]+ 450.35510142 225.3
[M]- 450.35619858 225.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe