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(-)-trans-Khellactone
SpectraBase Compound ID K0wVh83Li5B
InChI InChI=1S/C14H14O5/c1-14(2)13(17)11(16)10-8(19-14)5-3-7-4-6-9(15)18-12(7)10/h3-6,11,13,16-17H,1-2H3/t11-,13+/m0/s1
InChIKey HKXQUNNSKMWIKJ-WCQYABFASA-N
Mol Weight 262.26 g/mol
Molecular Formula C14H14O5
Exact Mass 262.084124 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4st5LFh1ADH
Name (+)-trans-KHELLACTONE
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Formula C14H14O5
InChI InChI=1S/C14H14O5/c1-14(2)13(17)11(16)10-8(19-14)5-3-7-4-6-9(15)18-12(7)10/h3-6,11,13,16-17H,1-2H3/t11-,13+/m0/s1
InChIKey HKXQUNNSKMWIKJ-WCQYABFASA-N
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany