CID 121235915

Cetyl peg/ppg-10/1 dimethicone

Structural Information

Molecular Formula
C29H68O6Si4
SMILES
CCCCCCCCCCCCCCCC[Si](C)(O[Si](C)(C)OCCOCC(C)O)O[Si](C)(C)O[Si](C)(C)C
InChI
InChI=1S/C29H68O6Si4/c1-11-12-13-14-15-16-17-18-19-20-21-22-23-24-27-39(10,35-38(8,9)33-36(3,4)5)34-37(6,7)32-26-25-31-28-29(2)30/h29-30H,11-28H2,1-10H3
InChIKey
NVCSYKRTCNTBMX-UHFFFAOYSA-N
Compound name
1-[2-[[[dimethyl(trimethylsilyloxy)silyl]oxy-hexadecyl-methylsilyl]oxy-dimethylsilyl]oxyethoxy]propan-2-ol
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

0
Patents

624.4093 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 625.41658 247.5
[M+Na]+ 647.39852 249.2
[M-H]- 623.40202 241.1
[M+NH4]+ 642.44312 252.9
[M+K]+ 663.37246 254.8
[M+H-H2O]+ 607.40656 239.9
[M+HCOO]- 669.40750 257.3
[M+CH3COO]- 683.42315 258.5
[M+Na-2H]- 645.38397 231.3
[M]+ 624.40875 252.3
[M]- 624.40985 252.3
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

No patent data available for this compound.