CID 57343740

Fluindapyr

Structural Information

Molecular Formula
C18H20F3N3O
SMILES
CC1CC(C2=C(C=CC(=C12)NC(=O)C3=CN(N=C3C(F)F)C)F)(C)C
InChI
InChI=1S/C18H20F3N3O/c1-9-7-18(2,3)14-11(19)5-6-12(13(9)14)22-17(25)10-8-24(4)23-15(10)16(20)21/h5-6,8-9,16H,7H2,1-4H3,(H,22,25)
InChIKey
XCGBHLLWJZOLEM-UHFFFAOYSA-N
Compound name
3-(difluoromethyl)-N-(7-fluoro-1,1,3-trimethyl-2,3-dihydroinden-4-yl)-1-methylpyrazole-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

5211
Patents

351.15585 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 352.16313 182.7
[M+Na]+ 374.14507 190.5
[M+NH4]+ 369.18967 188.3
[M+K]+ 390.11901 187.0
[M-H]- 350.14857 180.6
[M+Na-2H]- 372.13052 185.0
[M]+ 351.15530 182.9
[M]- 351.15640 182.9
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