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1,3-Dithiolane, 2-(4-methylphenyl)-
SpectraBase Compound ID BGpQgR9bXyf
InChI InChI=1S/C10H12S2/c1-8-2-4-9(5-3-8)10-11-6-7-12-10/h2-5,10H,6-7H2,1H3
InChIKey VKEBWCZVWZDPKV-UHFFFAOYSA-N
Mol Weight 196.33 g/mol
Molecular Formula C10H12S2
Exact Mass 196.038043 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CTBWKmeewUl
Name 1,3-Dithiolane, 2-(4-methylphenyl)-
CAS Registry Number 23229-29-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12S2
InChI InChI=1S/C10H12S2/c1-8-2-4-9(5-3-8)10-11-6-7-12-10/h2-5,10H,6-7H2,1H3
InChIKey VKEBWCZVWZDPKV-UHFFFAOYSA-N
Molecular Weight 196.326 g/mol
SMILES C1(SCCS1)c1ccc(cc1)C
SPLASH splash10-0f6t-4900000000-e9ea6ccbbd43f3bd0284
Source of Spectrum D1-2001-1643-0
Synonyms 1,3-Dithiolane, 2-p-tolyl- 2-(4-Methylphenyl)-1,3-dithiolane 2-(4'-Methylphenyl)-1,3-dithiolane 2-(p-Tolyl)-1,3-dithiolane BRN 0130878
Wiley ID 851233