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Isobenzofuran, 1,3,4,5,6,7-hexahydro-1,1-bis(methylthio)-
SpectraBase Compound ID 2MxMae0GkeT
InChI InChI=1S/C10H16OS2/c1-12-10(13-2)9-6-4-3-5-8(9)7-11-10/h3-7H2,1-2H3
InChIKey CNXGLGFNTAGGKZ-UHFFFAOYSA-N
Mol Weight 216.36 g/mol
Molecular Formula C10H16OS2
Exact Mass 216.064257 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CFID2AbFwkX
Name Isobenzofuran, 1,3,4,5,6,7-hexahydro-1,1-bis(methylthio)-
Alternate Name(s) 1,1-bis(methylsulfanyl)-1,3,4,5,6,7-hexahydro-2-benzofuran 1,1-bis(methylthio)-1,3,4,5,6,7-hexahydroisobenzofuran
CAS Registry Number 84735-56-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H16OS2
InChI InChI=1S/C10H16OS2/c1-12-10(13-2)9-6-4-3-5-8(9)7-11-10/h3-7H2,1-2H3
InChIKey CNXGLGFNTAGGKZ-UHFFFAOYSA-N
Molecular Weight 216.357 g/mol
SMILES C1(C2=C(CCCC2)CO1)(SC)SC
SPLASH splash10-016u-2900000000-a1000423d4414818a288
Source of Spectrum J-49-3822-0
Wiley ID 1215133