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4,5-Thiepanedione, 3,3,6,6-tetramethyl-
SpectraBase Compound ID 9RcPZetvrvM
InChI InChI=1S/C10H16O2S/c1-9(2)5-13-6-10(3,4)8(12)7(9)11/h5-6H2,1-4H3
InChIKey GFZNLWBRSSKIQN-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 9kMEkCNvstm
Name 4,5-Thiepanedione, 3,3,6,6-tetramethyl-
Alternate Name(s) 3,3,6,6-Tetramethyl-4,5-thiepanedione 1,2-Cycloheptanedione-5-thia, 3,3,7,7-tetramethyl- 3,3,6,6-tetramethylthiepane-4,5-dione 3,3,6,6-tetramethylthiepane-4,5-quinone
CAS Registry Number 2800-87-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H16O2S
InChI InChI=1S/C10H16O2S/c1-9(2)5-13-6-10(3,4)8(12)7(9)11/h5-6H2,1-4H3
InChIKey GFZNLWBRSSKIQN-UHFFFAOYSA-N
Molecular Weight 200.296 g/mol
SMILES C1SCC(C(C(C1(C)C)=O)=O)(C)C
SPLASH splash10-0a4i-9100000000-d694579fd5b3ea80bc9b
Wiley ID 1475585