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2-(2,2-dimethoxyethyl)-2-(3,3-dimethoxy-2-butyl)-1,3-dithiane
SpectraBase Compound ID ItSiPnOR1J3
InChI InChI=1S/C14H28O4S2/c1-11(13(2,17-5)18-6)14(10-12(15-3)16-4)19-8-7-9-20-14/h11-12H,7-10H2,1-6H3
InChIKey CTBDPKHSSRZYNR-UHFFFAOYSA-N
Mol Weight 324.49 g/mol
Molecular Formula C14H28O4S2
Exact Mass 324.142902 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FzDpFRD4cJk
Name 2-(2,2-dimethoxyethyl)-2-(3,3-dimethoxy-2-butyl)-1,3-dithiane
Alternate Name(s) 2-(2,2-dimethoxyethyl)-2-(2,2-dimethoxy-1-methylpropyl)-1,3-dithiane
CAS Registry Number 116149-54-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H28O4S2
InChI InChI=1S/C14H28O4S2/c1-11(13(2,17-5)18-6)14(10-12(15-3)16-4)19-8-7-9-20-14/h11-12H,7-10H2,1-6H3
InChIKey CTBDPKHSSRZYNR-UHFFFAOYSA-N
Molecular Weight 324.494 g/mol
SMILES C1(C(C(OC)(OC)C)C)(CC(OC)OC)SCCCS1
SPLASH splash10-00p1-9310000000-44db3103ab3bfdf17590
Source of Spectrum J-53-4908-50
Wiley ID 1322895