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(3-S,4-R,5-S,8-R,10-R)-TETRAHYDROPEREZINONE
SpectraBase Compound ID 6q9ZNJGz3AK
InChI InChI=1S/C15H22O3/c1-8-5-6-12-14(3,4)18-13-9(2)11(16)7-10(8)15(12,13)17/h7-9,12-13,17H,5-6H2,1-4H3/t8-,9-,12-,13-,15+/m1/s1
InChIKey NSKZHEJLXTXTRN-FRCJOOGCSA-N
Mol Weight 250.34 g/mol
Molecular Formula C15H22O3
Exact Mass 250.156895 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B2fQEMJugVd
Name (3-S,4-R,5-S,8-R,10-R)-TETRAHYDROPEREZINONE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H22O3
InChI InChI=1S/C15H22O3/c1-8-5-6-12-14(3,4)18-13-9(2)11(16)7-10(8)15(12,13)17/h7-9,12-13,17H,5-6H2,1-4H3/t8-,9-,12-,13-,15+/m1/s1
InChIKey NSKZHEJLXTXTRN-FRCJOOGCSA-N
Literature Reference Author Y.ZHANG,Y.B.LIU,Y.LI,S.G.MA,L.LI,J.QU,D.ZHANG,X.G.CHEN,J.D.J IANG,S.S.YU
Literature Reference Citation J.NAT.PROD.,76,1058(2013)
Literature Reference DOI 10.1021/np4000747
Molecular Weight 250.338 g/mol
Sample ID 42614
Solvent CDCl3