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trans-2-Isopropyl-4-methyl-1,3-dithiane
SpectraBase Compound ID I68s8xzwqIx
InChI InChI=1S/C8H16S2/c1-6(2)8-9-5-4-7(3)10-8/h6-8H,4-5H2,1-3H3/t7-,8-/m0/s1
InChIKey TTXIWAXYXUBQFC-YUMQZZPRSA-N
Mol Weight 176.34 g/mol
Molecular Formula C8H16S2
Exact Mass 176.069343 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H0uJPlMIrPt
Name TRANS-2-ISOPROPYL-4-METHYL-1,3-DITHIANE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H16S2
InChI InChI=1S/C8H16S2/c1-6(2)8-9-5-4-7(3)10-8/h6-8H,4-5H2,1-3H3/t7-,8-/m0/s1
InChIKey TTXIWAXYXUBQFC-YUMQZZPRSA-N
Literature Reference Author E.L.ELIEL,V.S.RAO,F.G.RIDDELL
Literature Reference Citation J.AM.CHEM.SOC.,98,3583(1976)
Literature Reference DOI 10.1021/ja00428a032
Molecular Weight 176.335 g/mol
Solvent CDCl3
Source File Reference UNIW16284