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LLALEXXCKCFLES-RNJXMRFFSA-N
SpectraBase Compound ID 4LD57RJKlTh
InChI InChI=1S/C9H16O3/c1-3-4-5-7-8(10)6(2)12-9(7)11/h6-8,10H,3-5H2,1-2H3/t6-,7+,8-/m0/s1
InChIKey LLALEXXCKCFLES-RNJXMRFFSA-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 As9IvhAC6TF
Name MKN-OO4A;2-BUTYL-3-HYDROXY-4-METHYL-GAMMA-BUTYROLACTONE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H16O3
InChI InChI=1S/C9H16O3/c1-3-4-5-7-8(10)6(2)12-9(7)11/h6-8,10H,3-5H2,1-2H3/t6-,7+,8-/m0/s1
InChIKey LLALEXXCKCFLES-RNJXMRFFSA-N
Literature Reference Author K.W.CHO,H.S.LEE,J.R.RHO,T.S.KIM,S.J.MO,J.SHIN
Literature Reference Citation J.NAT.PROD.,64,664(2001)
Literature Reference DOI 10.1021/np000599g
Molecular Weight 172.224 g/mol
Solvent CDCl3
Source File Reference UWRU7134