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2-METHYL-3-TETRAHYDROFURANTHIOL-4-ETHYLOCTANOATE
SpectraBase Compound ID EEN31lQmeR1
InChI InChI=1S/C15H28O2S/c1-4-6-7-13(5-2)8-9-15(16)18-14-10-11-17-12(14)3/h12-14H,4-11H2,1-3H3
InChIKey VWXOSPJHBNDLOO-UHFFFAOYSA-N
Mol Weight 272.45 g/mol
Molecular Formula C15H28O2S
Exact Mass 272.181001 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5KDMk0MHQ8J
Name 2-METHYL-3-TETRAHYDROFURANTHIOL-4-ETHYLOCTANOATE
Compound Number 3B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H28O2S
InChI InChI=1S/C15H28O2S/c1-4-6-7-13(5-2)8-9-15(16)18-14-10-11-17-12(14)3/h12-14H,4-11H2,1-3H3
InChIKey VWXOSPJHBNDLOO-UHFFFAOYSA-N
Literature Reference Author Y.LIU,H.CHEN,D.YIN,B.SUN
Literature Reference Citation MOLECULES,15,5104(2010)
Literature Reference DOI 10.3390/molecules15085104
Molecular Weight 272.446 g/mol
Sample ID 71071
Solvent CDCl3