CID 56841269

Einecs 303-091-8

Structural Information

Molecular Formula
C20H28F13N3O3Si
SMILES
CC/C(=N/O[Si](O/N=C(/CC)\C)(O/N=C(/CC)\C)CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)/C
InChI
InChI=1S/C20H28F13N3O3Si/c1-7-12(4)34-37-40(38-35-13(5)8-2,39-36-14(6)9-3)11-10-15(21,22)16(23,24)17(25,26)18(27,28)19(29,30)20(31,32)33/h7-11H2,1-6H3/b34-12+,35-13+,36-14+
InChIKey
ZISUJVTZTBMJQZ-JSOHPWBTSA-N
Compound name
(E)-N-[bis[[(E)-butan-2-ylideneamino]oxy]-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)silyl]oxybutan-2-imine
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

0
Patents

633.16925 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 634.17653 214.9
[M+Na]+ 656.15847 226.9
[M-H]- 632.16197 229.7
[M+NH4]+ 651.20307 232.1
[M+K]+ 672.13241 233.5
[M+H-H2O]+ 616.16651 206.7
[M+HCOO]- 678.16745 227.5
[M+CH3COO]- 692.18310 271.0
[M+Na-2H]- 654.14392 211.4
[M]+ 633.16870 211.1
[M]- 633.16980 211.1
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.