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(5aS,9aR)-spiro[2,4,5a,6,7,8,9,9a-octahydrobenzo[b][1,4]dithiepine-3,3'-oxetane]
SpectraBase Compound ID 7jgIcOFQbtk
InChI InChI=1S/C11H18OS2/c1-2-4-10-9(3-1)13-7-11(8-14-10)5-12-6-11/h9-10H,1-8H2/t9-,10+
InChIKey XJZSOYWHXCRHSD-AOOOYVTPSA-N
Mol Weight 230.38 g/mol
Molecular Formula C11H18OS2
Exact Mass 230.079908 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7D9ryBJWlme
Name (5aS,9aR)-spiro[2,4,5a,6,7,8,9,9a-octahydrobenzo[b][1,4]dithiepine-3,3'-oxetane]
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H18OS2
InChI InChI=1S/C11H18OS2/c1-2-4-10-9(3-1)13-7-11(8-14-10)5-12-6-11/h9-10H,1-8H2/t9-,10+
InChIKey XJZSOYWHXCRHSD-AOOOYVTPSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2010)
Molecular Weight 230.383 g/mol
Source File Reference MHKO26018