CID 10876220

Fenpyroximate m-8

Structural Information

Molecular Formula

C₁₂H₁₂N₂O₃

SMILES

CC1=NN(C(=C1C(=O)O)OC2=CC=CC=C2)C

InChI

InChI=1S/C12H12N2O3/c1-8-10(12(15)16)11(14(2)13-8)17-9-6-4-3-5-7-9/h3-7H,1-2H3,(H,15,16)

InChIKey

WIVBAMUMMYDDDW-UHFFFAOYSA-N

Compound name

1,3-dimethyl-5-phenoxypyrazole-4-carboxylic acid

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 0
References: 0
Patents: 232.0848 Da
Monoisotopic Mass: 2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	233.09208	151.0
[M+Na]+	255.07402	163.7
[M+NH4]+	250.11862	157.5
[M+K]+	271.04796	160.5
[M-H]-	231.07752	152.2
[M+Na-2H]-	253.05947	157.2
[M]+	232.08425	152.9
[M]-	232.08535	152.9

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.