CID 91753

Pyriproxyfen

Structural Information

Molecular Formula

C₂₀H₁₉NO₃

SMILES

CC(COC1=CC=C(C=C1)OC2=CC=CC=C2)OC3=CC=CC=N3

InChI

InChI=1S/C20H19NO3/c1-16(23-20-9-5-6-14-21-20)15-22-17-10-12-19(13-11-17)24-18-7-3-2-4-8-18/h2-14,16H,15H2,1H3

InChIKey

NHDHVHZZCFYRSB-UHFFFAOYSA-N

Compound name

2-[1-(4-phenoxyphenoxy)propan-2-yloxy]pyridine

Related CIDs

2D Structure

compound 2d structure

8
Annotation Hits: 610
References: 52239
Patents: 321.1365 Da
Monoisotopic Mass: 4.8
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]+	322.14378	176.8
[M+Na]+	344.12572	192.8
[M+NH4]+	339.17032	184.9
[M+K]+	360.09966	183.9
[M-H]-	320.12922	183.1
[M+Na-2H]-	342.11117	188.6
[M]+	321.13595	181.0
[M]-	321.13705	181.0

Literature stripe

literature stripe

Patent stripe

patents stripe