CID 49961

Fluorocyphenothrin

Structural Information

Molecular Formula
C22H19F2NO3
SMILES
CC1([C@@H]([C@@H]1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(F)F)C
InChI
InChI=1S/C22H19F2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/t17-,18?,20-/m1/s1
InChIKey
FWHRNWVIAOTDRA-IMBCPYESSA-N
Compound name
[cyano-(3-phenoxyphenyl)methyl] (1S,3S)-3-(2,2-difluoroethenyl)-2,2-dimethylcyclopropane-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

383.1333 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 384.14058 190.6
[M+Na]+ 406.12252 201.9
[M+NH4]+ 401.16712 194.1
[M+K]+ 422.09646 192.2
[M-H]- 382.12602 190.3
[M+Na-2H]- 404.10797 196.2
[M]+ 383.13275 192.3
[M]- 383.13385 192.3
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.