CID 138396371
[(4-{3-[(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)sulfanyl]propyl}-1,2-phenylene)bis(oxy)]bis(triethylsilane)
Structural Information
- Molecular Formula
- C29H43F13O2SSi2
- SMILES
- CC[Si](CC)(CC)OC1=C(C=C(C=C1)CCCSCCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O[Si](CC)(CC)CC
- InChI
- InChI=1S/C29H43F13O2SSi2/c1-7-46(8-2,9-3)43-22-16-15-21(20-23(22)44-47(10-4,11-5)12-6)14-13-18-45-19-17-24(30,31)25(32,33)26(34,35)27(36,37)28(38,39)29(40,41)42/h15-16,20H,7-14,17-19H2,1-6H3
- InChIKey
- SPMIFTWZBPRYPL-UHFFFAOYSA-N
- Compound name
- triethyl-[4-[3-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctylsulfanyl)propyl]-2-triethylsilyloxyphenoxy]silane
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 759.23873 | 237.5 |
[M+Na]+ | 781.22067 | 240.2 |
[M-H]- | 757.22417 | 236.2 |
[M+NH4]+ | 776.26527 | 246.2 |
[M+K]+ | 797.19461 | 252.2 |
[M+H-H2O]+ | 741.22871 | 225.4 |
[M+HCOO]- | 803.22965 | 256.1 |
[M+CH3COO]- | 817.24530 | 278.7 |
[M+Na-2H]- | 779.20612 | 226.7 |
[M]+ | 758.23090 | 239.7 |
[M]- | 758.23200 | 239.7 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.