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(1-R,2-S,4-R,5-R,9-S)-4,5-EPOXYCARYOPHYLLAN-8-ONE

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(1-R,2-S,4-R,5-R,9-S)-4,5-EPOXYCARYOPHYLLAN-8-ONE
SpectraBase Compound ID 7v3vU8kIM9R
InChI InChI=1S/C14H22O3/c1-13(2)6-8-9(15)4-5-11-14(3,17-11)7-10(16)12(8)13/h8,10-12,16H,4-7H2,1-3H3/t8-,10+,11-,12+,14-/m1/s1
InChIKey LPQILJLNNPWGIC-KSXHLQSHSA-N
Mol Weight 238.33 g/mol
Molecular Formula C14H22O3
Exact Mass 238.156895 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FUIMOxIZVSi
Name (1-R,2-S,4-R,5-R,9-S)-4,5-EPOXYCARYOPHYLLAN-8-ONE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H22O3
InChI InChI=1S/C14H22O3/c1-13(2)6-8-9(15)4-5-11-14(3,17-11)7-10(16)12(8)13/h8,10-12,16H,4-7H2,1-3H3/t8-,10+,11-,12+,14-/m1/s1
InChIKey LPQILJLNNPWGIC-KSXHLQSHSA-N
Literature Reference Author M.I.CHOUDHARY,Z.A.SIDDIQUI,S.A.NAWAZ,A.U.RAHMAN
Literature Reference Citation J.NAT.PROD.,69,1429(2006)
Literature Reference DOI 10.1021/np0680174
Molecular Weight 238.327 g/mol
Solvent CDCl3
Source File Reference UWMZ15789