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CIS-4,7-DIMETHYL-1,3-DITHIA-5,6-BENZCYCLOHEPTENE (CONFORMER 2)
SpectraBase Compound ID Fi5YnKMC3vX
InChI InChI=1S/C11H14S2/c1-8-10-5-3-4-6-11(10)9(2)13-7-12-8/h3-6,8-9H,7H2,1-2H3/t8-,9-/m1/s1
InChIKey YXBPQZZONHPSIH-RKDXNWHRSA-N
Mol Weight 210.35 g/mol
Molecular Formula C11H14S2
Exact Mass 210.053693 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8B7pfqgO4UA
Name CIS-4,7-DIMETHYL-1,3-DITHIA-5,6-BENZCYCLOHEPTENE (CONFORMER 2)
Comments -D
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Formula C11H14S2
InChI InChI=1S/C11H14S2/c1-8-10-5-3-4-6-11(10)9(2)13-7-12-8/h3-6,8-9H,7H2,1-2H3/t8-,9-/m1/s1
InChIKey YXBPQZZONHPSIH-RKDXNWHRSA-N
Instrument Name Bruker WM-250
Literature Reference E.N.KLIMOVITSKY, D.YU.STREL'NIK, V.V.KLOCHKOV, SH.K.LATYPOV (1992)Zhurn.Org.Khim.(Russ. Lang.): v.28, N8, 1587-1596.
NMR Standard HMDS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CS2/CD2Cl2