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LFKSRWRSZVCLFJ-CPWYHZLMSA-N

View entire compound with spectra: 2 NMR

LFKSRWRSZVCLFJ-CPWYHZLMSA-N
SpectraBase Compound ID A67yx9xPNkt
InChI InChI=1S/C15H20O3/c1-8-6-12(16)15-9(2)10(13(17)18)7-14(15,3)5-4-11(8)15/h7-9,11H,4-6H2,1-3H3,(H,17,18)/t8-,9+,11+,14+,15+/m0/s1
InChIKey LFKSRWRSZVCLFJ-CPWYHZLMSA-N
Mol Weight 248.32 g/mol
Molecular Formula C15H20O3
Exact Mass 248.141245 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HZ7R5bgIqZ4
Name SUBERGORGIC-ACID
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H20O3
InChI InChI=1S/C15H20O3/c1-8-6-12(16)15-9(2)10(13(17)18)7-14(15,3)5-4-11(8)15/h7-9,11H,4-6H2,1-3H3,(H,17,18)/t8-,9+,11+,14+,15+/m0/s1
InChIKey LFKSRWRSZVCLFJ-CPWYHZLMSA-N
Literature Reference Author G.H.WANG,A.F.AHMED,Y.H.KUO,J.H.SHEU
Literature Reference Citation J.NAT.PROD.,65,1033(2002)
Literature Reference DOI 10.1021/np0106586
Molecular Weight 248.322 g/mol
Solvent CDCl3
Source File Reference UWSI6230