CID 139594378

Ns00065431

Structural Information

Molecular Formula
C37H41F13O14Si
SMILES
C=CC(=O)OCC(COC[SiH](CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)OCC(COC(=O)C=C)(COC(=O)C=C)COC(=O)C=C)(COC(=O)C=C)COC(=O)C=C
InChI
InChI=1S/C37H41F13O14Si/c1-7-24(51)58-16-30(17-59-25(52)8-2,18-60-26(53)9-3)15-57-23-65(14-13-32(38,39)33(40,41)34(42,43)35(44,45)36(46,47)37(48,49)50)64-22-31(19-61-27(54)10-4,20-62-28(55)11-5)21-63-29(56)12-6/h7-12,65H,1-6,13-23H2
InChIKey
BNLPWLDLWVJTKW-UHFFFAOYSA-N
Compound name
[3-prop-2-enoyloxy-2-[[[3-prop-2-enoyloxy-2,2-bis(prop-2-enoyloxymethyl)propoxy]-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)silyl]methoxymethyl]-2-(prop-2-enoyloxymethyl)propyl] prop-2-enoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

984.2058 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 985.21308 292.9
[M+Na]+ 1007.1950 297.4
[M-H]- 983.19852 314.0
[M+NH4]+ 1002.2396 321.7
[M+K]+ 1023.1690 311.4
[M+H-H2O]+ 967.20306 284.1
[M+HCOO]- 1029.2040 294.9
[M+CH3COO]- 1043.2197 300.4
[M+Na-2H]- 1005.1805 282.1
[M]+ 984.20525 302.9
[M]- 984.20635 302.9
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.