CID 71245

Etofenprox

Structural Information

Molecular Formula

C₂₅H₂₈O₃

SMILES

CCOC1=CC=C(C=C1)C(C)(C)COCC2=CC(=CC=C2)OC3=CC=CC=C3

InChI

InChI=1S/C25H28O3/c1-4-27-22-15-13-21(14-16-22)25(2,3)19-26-18-20-9-8-12-24(17-20)28-23-10-6-5-7-11-23/h5-17H,4,18-19H2,1-3H3

InChIKey

YREQHYQNNWYQCJ-UHFFFAOYSA-N

Compound name

1-ethoxy-4-[2-methyl-1-[(3-phenoxyphenyl)methoxy]propan-2-yl]benzene

Related CIDs

2D Structure

compound 2d structure

8
Annotation Hits: 136
References: 39730
Patents: 376.20386 Da
Monoisotopic Mass: 7.0
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]+	377.211136	194.9
[M+Na]+	399.193078	199.8
[M-H]-	375.196584	203.7
[M+NH4]+	394.237683	206.2
[M+K]+	415.167018	195.3
[M+H-H2O]+	359.201120	184.6
[M+HCOO]-	421.202061	215.6
[M+CH3COO]-	435.217711	219.4
[M+Na-2H]-	397.178526	198.6
[M]+	376.20331142	199.3
[M]-	376.20440858	199.3

Literature stripe

literature stripe

Patent stripe

patents stripe