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4-tert-Butyl-2,7-dihydro-1H-thiepin-1,1-dione
SpectraBase Compound ID COoIc9YEFp
InChI InChI=1S/C10H16O2S/c1-10(2,3)9-5-4-7-13(11,12)8-6-9/h4-6H,7-8H2,1-3H3
InChIKey CKXIHPGBURUGSU-UHFFFAOYSA-N
Mol Weight 200.3 g/mol
Molecular Formula C10H16O2S
Exact Mass 200.087101 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DppsNLd5KS0
Name 4-tert-Butyl-2,7-dihydro-1H-thiepin-1,1-dione
Alternate Name(s) 4-tert-Butyl-2,7-dihydrothiepin 1,1-dioxide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H16O2S
InChI InChI=1S/C10H16O2S/c1-10(2,3)9-5-4-7-13(11,12)8-6-9/h4-6H,7-8H2,1-3H3
InChIKey CKXIHPGBURUGSU-UHFFFAOYSA-N
Molecular Weight 200.296 g/mol
SMILES C1S(=O)(=O)CC=CC(=C1)C(C)(C)C
SPLASH splash10-05i3-9700000000-8187a30cece9ecd9d74f
Source of Spectrum H1-53-902-6
Wiley ID 817998