CID 47898

Flutolanil

Structural Information

Molecular Formula
C17H16F3NO2
SMILES
CC(C)OC1=CC=CC(=C1)NC(=O)C2=CC=CC=C2C(F)(F)F
InChI
InChI=1S/C17H16F3NO2/c1-11(2)23-13-7-5-6-12(10-13)21-16(22)14-8-3-4-9-15(14)17(18,19)20/h3-11H,1-2H3,(H,21,22)
InChIKey
PTCGDEVVHUXTMP-UHFFFAOYSA-N
Compound name
N-(3-propan-2-yloxyphenyl)-2-(trifluoromethyl)benzamide
Related CIDs

2D Structure

compound 2d structure
7
Annotation Hits

51
References

43472
Patents

323.1133 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 324.12058 175.6
[M+Na]+ 346.10252 184.6
[M+NH4]+ 341.14712 180.3
[M+K]+ 362.07646 179.1
[M-H]- 322.10602 174.5
[M+Na-2H]- 344.08797 180.7
[M]+ 323.11275 176.3
[M]- 323.11385 176.3
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