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4-HYDROXY-5-METHYL-3-PROPYL-2,5-DIHYDRO-2-THIOPHENE
SpectraBase Compound ID KjdVwYDBdPI
InChI InChI=1S/C8H12O2S/c1-3-4-6-7(9)5(2)11-8(6)10/h5,9H,3-4H2,1-2H3
InChIKey VJPMXKXALLLPNY-UHFFFAOYSA-N
Mol Weight 172.24 g/mol
Molecular Formula C8H12O2S
Exact Mass 172.055801 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 92u2XZ5ewd3
Name 4-HYDROXY-5-METHYL-3-PROPYL-2,5-DIHYDRO-2-THIOPHENE
Compound Number 6C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H12O2S
InChI InChI=1S/C8H12O2S/c1-3-4-6-7(9)5(2)11-8(6)10/h5,9H,3-4H2,1-2H3
InChIKey VJPMXKXALLLPNY-UHFFFAOYSA-N
Literature Reference Author S.M.JONES,J.E.URCH,R.BRUN,J.L.HARWOOD,C.BERRY,I.H.GILBERT
Literature Reference Citation BIOORG.MED.CHEM.,12,683(2004)
Molecular Weight 172.242 g/mol
Solvent ACETONE-D6
Source File Reference UWMB1317