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(4aS,8aR)-4a,5,6,7,8,8a-hexahydrobenzo[e][1,4]oxathiin-2-one
SpectraBase Compound ID 8jRe7r81L8q
InChI InChI=1S/C8H12O2S/c9-8-5-11-7-4-2-1-3-6(7)10-8/h6-7H,1-5H2/t6-,7+/m1/s1
InChIKey UBVZSANIIDEPCE-RQJHMYQMSA-N
Mol Weight 172.24 g/mol
Molecular Formula C8H12O2S
Exact Mass 172.055801 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 71EnNE9JON
Name (4aS,8aR)-4a,5,6,7,8,8a-hexahydrobenzo[e][1,4]oxathiin-2-one
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H12O2S
InChI InChI=1S/C8H12O2S/c9-8-5-11-7-4-2-1-3-6(7)10-8/h6-7H,1-5H2/t6-,7+/m1/s1
InChIKey UBVZSANIIDEPCE-RQJHMYQMSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2006)
Molecular Weight 172.242 g/mol
Source File Reference MHKO2403