CID 155887701

Silsense dw-18 silicone

Structural Information

Molecular Formula
C44H96O13Si4
SMILES
CCCCCCCCCCCCCCCC(C)C(=O)OC(C)COCCOCCOCCOCCOCCOCCOCCO[Si](C)(O[Si](C)(C)C)O[Si](C)(C)O[Si](C)(C)C
InChI
InChI=1S/C44H96O13Si4/c1-13-14-15-16-17-18-19-20-21-22-23-24-25-26-42(2)44(45)54-43(3)41-52-38-37-50-34-33-48-30-29-46-27-28-47-31-32-49-35-36-51-39-40-53-61(12,56-59(7,8)9)57-60(10,11)55-58(4,5)6/h42-43H,13-41H2,1-12H3
InChIKey
XMDGYJLKKBTJNX-UHFFFAOYSA-N
Compound name
1-[2-[2-[2-[2-[2-[2-[2-[[dimethyl(trimethylsilyloxy)silyl]oxy-methyl-trimethylsilyloxysilyl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propan-2-yl 2-methylheptadecanoate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

944.5928 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 945.60008 316.4
[M+Na]+ 967.58202 314.4
[M-H]- 943.58552 313.0
[M+NH4]+ 962.62662 332.5
[M+K]+ 983.55596 326.1
[M+H-H2O]+ 927.59006 310.6
[M+HCOO]- 989.59100 317.0
[M+CH3COO]- 1003.6067 309.6
[M+Na-2H]- 965.56747 294.0
[M]+ 944.59225 328.3
[M]- 944.59335 328.3
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.