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1,3-Benzodithiole, 2-ethyl-2-(1-methylethyl)-, 1,1,3,3-tetraoxide
SpectraBase Compound ID 9VzjqReOMI8
InChI InChI=1S/C12H16O4S2/c1-4-12(9(2)3)17(13,14)10-7-5-6-8-11(10)18(12,15)16/h5-9H,4H2,1-3H3
InChIKey XMCOTZMNCULNSR-UHFFFAOYSA-N
Mol Weight 288.38 g/mol
Molecular Formula C12H16O4S2
Exact Mass 288.049001 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JuvRt826Wu3
Name 1,3-Benzodithiole, 2-ethyl-2-(1-methylethyl)-, 1,1,3,3-tetraoxide
Alternate Name(s) 2-Ethyl-2-isopropyl-1,3-benzodithiole 1,1,3,3-tetraoxide 2-Isopropyl-2-ethyl-1,3-benzodithiole-1,1,3,3-tetraoxide
CAS Registry Number 121163-82-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O4S2
InChI InChI=1S/C12H16O4S2/c1-4-12(9(2)3)17(13,14)10-7-5-6-8-11(10)18(12,15)16/h5-9H,4H2,1-3H3
InChIKey XMCOTZMNCULNSR-UHFFFAOYSA-N
Molecular Weight 288.376 g/mol
SMILES C1(S(c2c(S1(=O)=O)cccc2)(=O)=O)(C(C)C)CC
SPLASH splash10-053r-9000000000-14850695117bb4e72f16
Source of Spectrum F-44-6859-6
Wiley ID 1291290