CID 162396546

Dtxsid901032889

Structural Information

Molecular Formula
C9H9F13O2Si
SMILES
C[Si](CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(O)O
InChI
InChI=1S/C9H9F13O2Si/c1-25(23,24)3-2-4(10,11)5(12,13)6(14,15)7(16,17)8(18,19)9(20,21)22/h23-24H,2-3H2,1H3
InChIKey
LRQLWMCEQLIUIQ-UHFFFAOYSA-N
Compound name
dihydroxy-methyl-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)silane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

424.01642 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 425.02370 179.8
[M+Na]+ 447.00564 187.5
[M-H]- 423.00914 160.5
[M+NH4]+ 442.05024 161.0
[M+K]+ 462.97958 184.2
[M+H-H2O]+ 407.01368 167.1
[M+HCOO]- 469.01462 175.7
[M+CH3COO]- 483.03027 218.9
[M+Na-2H]- 444.99109 183.2
[M]+ 424.01587 155.4
[M]- 424.01697 155.4
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.