CID 11158353

Fluopyram

Structural Information

Molecular Formula
C16H11ClF6N2O
SMILES
C1=CC=C(C(=C1)C(=O)NCCC2=C(C=C(C=N2)C(F)(F)F)Cl)C(F)(F)F
InChI
InChI=1S/C16H11ClF6N2O/c17-12-7-9(15(18,19)20)8-25-13(12)5-6-24-14(26)10-3-1-2-4-11(10)16(21,22)23/h1-4,7-8H,5-6H2,(H,24,26)
InChIKey
KVDJTXBXMWJJEF-UHFFFAOYSA-N
Compound name
N-[2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]ethyl]-2-(trifluoromethyl)benzamide
Related CIDs

2D Structure

compound 2d structure
7
Annotation Hits

92
References

17972
Patents

396.04642 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 397.05370 182.6
[M+Na]+ 419.03564 192.4
[M-H]- 395.03914 180.5
[M+NH4]+ 414.08024 193.1
[M+K]+ 435.00958 184.7
[M+H-H2O]+ 379.04368 169.9
[M+HCOO]- 441.04462 191.1
[M+CH3COO]- 455.06027 219.9
[M+Na-2H]- 417.02109 184.3
[M]+ 396.04587 177.5
[M]- 396.04697 177.5
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.