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2-Methyl-2-(4-hydroxyphenyl)-1,3-dithiane
SpectraBase Compound ID GyJkhAikFk
InChI InChI=1S/C11H14OS2/c1-11(13-7-2-8-14-11)9-3-5-10(12)6-4-9/h3-6,12H,2,7-8H2,1H3
InChIKey HHCTXWWPKXCRMG-UHFFFAOYSA-N
Mol Weight 226.35 g/mol
Molecular Formula C11H14OS2
Exact Mass 226.048607 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2gjXRjCZF2
Name 2-Methyl-2-(4-hydroxyphenyl)-1,3-dithiane
Alternate Name(s) 4-(2-Methyl-1,3-dithian-2-yl)phenol
CAS Registry Number 155853-28-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H14OS2
InChI InChI=1S/C11H14OS2/c1-11(13-7-2-8-14-11)9-3-5-10(12)6-4-9/h3-6,12H,2,7-8H2,1H3
InChIKey HHCTXWWPKXCRMG-UHFFFAOYSA-N
Molecular Weight 226.352 g/mol
SMILES Oc1ccc(cc1)C1(C)SCCCS1
SPLASH splash10-0ufr-1940000000-bc2de9b75b014ed6d981
Source of Spectrum O-30-461-0
Wiley ID 1226998