CID 139598089

Flutolanil m-5 hdp

Structural Information

Molecular Formula
C14H10F3NO3
SMILES
C1=CC=C(C(=C1)C(=O)NC2=CC(=C(C=C2)O)O)C(F)(F)F
InChI
InChI=1S/C14H10F3NO3/c15-14(16,17)10-4-2-1-3-9(10)13(21)18-8-5-6-11(19)12(20)7-8/h1-7,19-20H,(H,18,21)
InChIKey
YTWSYFMRWSRSNT-UHFFFAOYSA-N
Compound name
N-(3,4-dihydroxyphenyl)-2-(trifluoromethyl)benzamide
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

0
References

0
Patents

297.06128 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 298.06856 161.7
[M+Na]+ 320.05050 169.8
[M-H]- 296.05400 162.5
[M+NH4]+ 315.09510 175.3
[M+K]+ 336.02444 165.1
[M+H-H2O]+ 280.05854 152.4
[M+HCOO]- 342.05948 179.0
[M+CH3COO]- 356.07513 199.1
[M+Na-2H]- 318.03595 164.9
[M]+ 297.06073 156.4
[M]- 297.06183 156.4
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

No patent data available for this compound.