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Methyl 3,3-diphenyl-1,4-dithiane-2-carboxylate

View entire compound with spectra: 1 MS (GC)

Methyl 3,3-diphenyl-1,4-dithiane-2-carboxylate
SpectraBase Compound ID B8npSJBIA9h
InChI InChI=1S/C18H18O2S2/c1-20-17(19)16-18(22-13-12-21-16,14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2-11,16H,12-13H2,1H3
InChIKey DJOQCGMOQZBASC-UHFFFAOYSA-N
Mol Weight 330.46 g/mol
Molecular Formula C18H18O2S2
Exact Mass 330.074822 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2DpuydbjMO5
Name Methyl 3,3-diphenyl-1,4-dithiane-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18O2S2
InChI InChI=1S/C18H18O2S2/c1-20-17(19)16-18(22-13-12-21-16,14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2-11,16H,12-13H2,1H3
InChIKey DJOQCGMOQZBASC-UHFFFAOYSA-N
Molecular Weight 330.460 g/mol
SMILES C1(SCCSC1(c1ccccc1)c1ccccc1)C(=O)OC
SPLASH splash10-015d-3924000000-bd3f0c19331eea0886b5
Source of Spectrum F-62-3616-9
Wiley ID 1633008