CID 102380609

6,11,14,17-tetraoxa-7-silaeicos-1-yn-3-ol, 7,7-dibutyl-13,15,15,16,18,18,19,19,20,20,20-undecafluoro-3-methyl-13,16-bis(trifluoromethyl)-

Structural Information

Molecular Formula
C26H35F17O5Si
SMILES
CCCC[Si](CCCC)(CCCOCC(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F)(F)F)F)OCCC(C)(C#C)O
InChI
InChI=1S/C26H35F17O5Si/c1-5-8-14-49(15-9-6-2,46-13-11-18(4,44)7-3)16-10-12-45-17-19(27,22(31,32)33)47-26(42,43)21(30,24(37,38)39)48-25(40,41)20(28,29)23(34,35)36/h3,44H,5-6,8-17H2,1-2,4H3
InChIKey
GYGAJGKPDXOWIL-UHFFFAOYSA-N
Compound name
5-[dibutyl-[3-[2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propoxy]propyl]silyl]oxy-3-methylpent-1-yn-3-ol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

778.19824 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 779.20552 237.7
[M+Na]+ 801.18746 238.0
[M-H]- 777.19096 243.6
[M+NH4]+ 796.23206 247.6
[M+K]+ 817.16140 251.6
[M+H-H2O]+ 761.19550 224.3
[M+HCOO]- 823.19644 251.3
[M+CH3COO]- 837.21209 273.1
[M+Na-2H]- 799.17291 230.8
[M]+ 778.19769 238.7
[M]- 778.19879 238.7
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.