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TRANS-2-(1-METHYL-1-BENZYLOXYETHYL)-1,3-DITHIANE_1-OXIDE
SpectraBase Compound ID 3qZdWpHeoTM
InChI InChI=1S/C14H20O2S2/c1-14(2,13-17-9-6-10-18(13)15)16-11-12-7-4-3-5-8-12/h3-5,7-8,13H,6,9-11H2,1-2H3/t13-,18?/m1/s1
InChIKey ISWRWTGNMMMROK-YJJYDOSJSA-N
Mol Weight 284.43 g/mol
Molecular Formula C14H20O2S2
Exact Mass 284.090472 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5W6DmfITQ3j
Name TRANS-2-(1-METHYL-1-BENZYLOXYETHYL)-1,3-DITHIANE_1-OXIDE
Compound Number 2F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H20O2S2
InChI InChI=1S/C14H20O2S2/c1-14(2,13-17-9-6-10-18(13)15)16-11-12-7-4-3-5-8-12/h3-5,7-8,13H,6,9-11H2,1-2H3/t13-,18?/m1/s1
InChIKey ISWRWTGNMMMROK-YJJYDOSJSA-N
Literature Reference Author Y.WATANABE,Y.OHNO,Y.UENO,T.TORU
Literature Reference Citation J.CHEM.SOC.PERKIN-1,1087(1998)
Literature Reference DOI 10.1039/a708265g
Molecular Weight 284.432 g/mol
Solvent CDCl3