CID 92430

Silafluofen

Structural Information

Molecular Formula
C25H29FO2Si
SMILES
CCOC1=CC=C(C=C1)[Si](C)(C)CCCC2=CC(=C(C=C2)F)OC3=CC=CC=C3
InChI
InChI=1S/C25H29FO2Si/c1-4-27-21-13-15-23(16-14-21)29(2,3)18-8-9-20-12-17-24(26)25(19-20)28-22-10-6-5-7-11-22/h5-7,10-17,19H,4,8-9,18H2,1-3H3
InChIKey
HPYNBECUCCGGPA-UHFFFAOYSA-N
Compound name
(4-ethoxyphenyl)-[3-(4-fluoro-3-phenoxyphenyl)propyl]-dimethylsilane
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

8
References

27536
Patents

408.19208 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 409.19936 201.3
[M+Na]+ 431.18130 206.8
[M-H]- 407.18480 208.7
[M+NH4]+ 426.22590 212.1
[M+K]+ 447.15524 200.9
[M+H-H2O]+ 391.18934 190.0
[M+HCOO]- 453.19028 220.2
[M+CH3COO]- 467.20593 224.3
[M+Na-2H]- 429.16675 202.8
[M]+ 408.19153 203.9
[M]- 408.19263 203.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe