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ISOSEIRIDIN;3-METHYL-4-(5-HYDROXYHEPTYL)-2-(5H)-FURANONE
SpectraBase Compound ID HrqeyVNxear
InChI InChI=1S/C12H20O3/c1-3-11(13)7-5-4-6-10-8-15-12(14)9(10)2/h11,13H,3-8H2,1-2H3
InChIKey RRJPBACYMZWMBB-UHFFFAOYSA-N
Mol Weight 212.29 g/mol
Molecular Formula C12H20O3
Exact Mass 212.141245 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EtzK7pSSRSA
Name ISOSEIRIDIN;3-METHYL-4-(5-HYDROXYHEPTYL)-2-(5H)-FURANONE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H20O3
InChI InChI=1S/C12H20O3/c1-3-11(13)7-5-4-6-10-8-15-12(14)9(10)2/h11,13H,3-8H2,1-2H3
InChIKey RRJPBACYMZWMBB-UHFFFAOYSA-N
Literature Reference Author A.EVIDENTE,L.SPARAPANO
Literature Reference Citation J.NAT.PROD.,57,1720(1994)
Literature Reference DOI 10.1021/np50114a017
Molecular Weight 212.289 g/mol
Solvent CDCl3
Source File Reference UWVP13