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1,3-Dithiane, 2-(4-methoxyphenyl)-2-methyl-
SpectraBase Compound ID DMRcw05TJ5M
InChI InChI=1S/C12H16OS2/c1-12(14-8-3-9-15-12)10-4-6-11(13-2)7-5-10/h4-7H,3,8-9H2,1-2H3
InChIKey JBZJMFXDWLBUOQ-UHFFFAOYSA-N
Mol Weight 240.38 g/mol
Molecular Formula C12H16OS2
Exact Mass 240.064257 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6t1f1NtMZAI
Name 1,3-Dithiane, 2-(4-methoxyphenyl)-2-methyl-
Alternate Name(s) 2-(4-Methoxyphenyl)-2-methyl-1,3-dithiane
CAS Registry Number 77464-22-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16OS2
InChI InChI=1S/C12H16OS2/c1-12(14-8-3-9-15-12)10-4-6-11(13-2)7-5-10/h4-7H,3,8-9H2,1-2H3
InChIKey JBZJMFXDWLBUOQ-UHFFFAOYSA-N
Molecular Weight 240.379 g/mol
SMILES C1(SCCCS1)(c1ccc(cc1)OC)C
SPLASH splash10-0f7o-0960000000-168811fd82165891c7ca
Source of Spectrum O-21-336-2
Wiley ID 1242616