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PRELACTONE-B;(4R,5S,6R)-TETRAHYDRO-4-HYDROXY-6-ISOPROPYL-5-METHYL-2H-PYRAN-2-ONE
SpectraBase Compound ID 4z7z8rePuGI
InChI InChI=1S/C9H16O3/c1-5(2)9-6(3)7(10)4-8(11)12-9/h5-7,9-10H,4H2,1-3H3/t6-,7+,9+/m0/s1
InChIKey GZGROEXVPWSNDV-LKEWCRSYSA-N
Mol Weight 172.22 g/mol
Molecular Formula C9H16O3
Exact Mass 172.109944 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8J0a2y4AKIu
Name PRELACTONE-B;(4R,5S,6R)-TETRAHYDRO-4-HYDROXY-6-ISOPROPYL-5-METHYL-2H-PYRAN-2-ONE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H16O3
InChI InChI=1S/C9H16O3/c1-5(2)9-6(3)7(10)4-8(11)12-9/h5-7,9-10H,4H2,1-3H3/t6-,7+,9+/m0/s1
InChIKey GZGROEXVPWSNDV-LKEWCRSYSA-N
Literature Reference Author K.U.BINDSEIL,A.ZEECK
Literature Reference Citation HELV.CHIM.ACTA,76,150(1993)
Literature Reference DOI 10.1002/hlca.19930760109
Molecular Weight 172.224 g/mol
Solvent CDCl3
Source File Reference UWCS15252