CID 91701

Fluazifop

Structural Information

Molecular Formula
C15H12F3NO4
SMILES
CC(C(=O)O)OC1=CC=C(C=C1)OC2=NC=C(C=C2)C(F)(F)F
InChI
InChI=1S/C15H12F3NO4/c1-9(14(20)21)22-11-3-5-12(6-4-11)23-13-7-2-10(8-19-13)15(16,17)18/h2-9H,1H3,(H,20,21)
InChIKey
YUVKUEAFAVKILW-UHFFFAOYSA-N
Compound name
2-[4-[5-(trifluoromethyl)pyridin-2-yl]oxyphenoxy]propanoic acid
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

44
References

24404
Patents

327.07184 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 328.07912 173.4
[M+Na]+ 350.06106 182.2
[M+NH4]+ 345.10566 176.6
[M+K]+ 366.03500 178.4
[M-H]- 326.06456 170.0
[M+Na-2H]- 348.04651 177.5
[M]+ 327.07129 173.3
[M]- 327.07239 173.3
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