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(+/-)-[(5RS,6RS,9RS)-5,6,7,8,9,10-HEXAHYDRO-5,9-EPOXY-BENZOCYCLOOCTEN-6-YL]-METHANESULFONATE
SpectraBase Compound ID QRzpJP5I5k
InChI InChI=1S/C13H16O4S/c1-18(14,15)17-12-7-6-10-8-9-4-2-3-5-11(9)13(12)16-10/h2-5,10,12-13H,6-8H2,1H3/t10-,12-,13-/m0/s1
InChIKey ORBXRZGISHBHTI-DRZSPHRISA-N
Mol Weight 268.33 g/mol
Molecular Formula C13H16O4S
Exact Mass 268.07693 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3rQiKOT4DYl
Name (+/-)-[(5RS,6RS,9RS)-5,6,7,8,9,10-HEXAHYDRO-5,9-EPOXY-BENZOCYCLOOCTEN-6-YL]-METHANESULFONATE
Compound Number 26B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H16O4S
InChI InChI=1S/C13H16O4S/c1-18(14,15)17-12-7-6-10-8-9-4-2-3-5-11(9)13(12)16-10/h2-5,10,12-13H,6-8H2,1H3/t10-,12-,13-/m0/s1
InChIKey ORBXRZGISHBHTI-DRZSPHRISA-N
Literature Reference Author C.KETTERER,B.WUENSCH
Literature Reference Citation EUR.J.ORG.CHEM.,2012,2428(2012)
Literature Reference DOI 10.1002/ejoc.201101800
Molecular Weight 268.328 g/mol
Solvent CDCl3
Source File Reference UWLU84756