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Methyl 5,5-Dichloro-4,4-difluoro-5-(2-pyridylthio)pentanoate

View entire compound with spectra: 1 MS (GC)

Methyl 5,5-Dichloro-4,4-difluoro-5-(2-pyridylthio)pentanoate
SpectraBase Compound ID CSgOAcPGdgO
InChI InChI=1S/C11H11Cl2F2NO2S/c1-18-9(17)5-6-10(14,15)11(12,13)19-8-4-2-3-7-16-8/h2-4,7H,5-6H2,1H3
InChIKey KXDJQAKTQSDDPU-UHFFFAOYSA-N
Mol Weight 330.18 g/mol
Molecular Formula C11H11Cl2F2NO2S
Exact Mass 328.985561 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LFOhbrUHHb3
Name Methyl 5,5-Dichloro-4,4-difluoro-5-(2-pyridylthio)pentanoate
Alternate Name(s) methyl 5,5-dichloro-4,4-difluoro-5-(2-pyridinylsulfanyl)pentanoate
Comments Less than 3 mono-isotopic peaks
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Formula C11H11Cl2F2NO2S
InChI InChI=1S/C11H11Cl2F2NO2S/c1-18-9(17)5-6-10(14,15)11(12,13)19-8-4-2-3-7-16-8/h2-4,7H,5-6H2,1H3
InChIKey KXDJQAKTQSDDPU-UHFFFAOYSA-N
Molecular Weight 330.177 g/mol
SMILES C(CCC(C(Sc1ccccn1)(Cl)Cl)(F)F)(=O)OC
SPLASH splash10-0006-0090000000-98779830a06b70ffc335
Source of Spectrum F-51-1913-8
Wiley ID 790841