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1-(dichloracetyl)-4,5,6,7,8,9-hexahydro-3-(methylthio)cycloocta[c]furan
SpectraBase Compound ID L8HriZgyWus
InChI InChI=1S/C13H16Cl2O2S/c1-18-13-9-7-5-3-2-4-6-8(9)11(17-13)10(16)12(14)15/h12H,2-7H2,1H3
InChIKey TYHXHJHKMOQHHA-UHFFFAOYSA-N
Mol Weight 307.24 g/mol
Molecular Formula C13H16Cl2O2S
Exact Mass 306.024806 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3fOPJCTPQTQ
Name 1-(dichloracetyl)-4,5,6,7,8,9-hexahydro-3-(methylthio)cycloocta[c]furan
Alternate Name(s) 2,2-Dichloro-1-[3-(methylsulfanyl)-4,5,6,7,8,9-hexahydrocycloocta[c]furan-1-yl]ethanone
CAS Registry Number 102435-90-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16Cl2O2S
InChI InChI=1S/C13H16Cl2O2S/c1-18-13-9-7-5-3-2-4-6-8(9)11(17-13)10(16)12(14)15/h12H,2-7H2,1H3
InChIKey TYHXHJHKMOQHHA-UHFFFAOYSA-N
Molecular Weight 307.235 g/mol
SMILES c1(oc(SC)c2c1CCCCCC2)C(C(Cl)Cl)=O
SPLASH splash10-00di-0293000000-a8ca9a8190cfa362b162
Source of Spectrum K-119-2337-21
Wiley ID 1307725