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(-)-(2-S,3-R,R(S))-2-N-BUTYL-3-(PARA-TOLYLSULFINYL)-3,6-DIHYDRO-2H-PYRAN
SpectraBase Compound ID INqXoMkMAxg
InChI InChI=1S/C16H22O2S/c1-3-4-6-15-16(7-5-12-18-15)19(17)14-10-8-13(2)9-11-14/h5,7-11,15-16H,3-4,6,12H2,1-2H3/t15-,16+,19?/m0/s1
InChIKey UPVFIQZUTMASLK-GWFKTICUSA-N
Mol Weight 278.41 g/mol
Molecular Formula C16H22O2S
Exact Mass 278.134051 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6cnYnlLnpc3
Name (-)-(2-S,3-R,R(S))-2-N-BUTYL-3-(PARA-TOLYLSULFINYL)-3,6-DIHYDRO-2H-PYRAN
Compound Number 2A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H22O2S
InChI InChI=1S/C16H22O2S/c1-3-4-6-15-16(7-5-12-18-15)19(17)14-10-8-13(2)9-11-14/h5,7-11,15-16H,3-4,6,12H2,1-2H3/t15-,16+,19?/m0/s1
InChIKey UPVFIQZUTMASLK-GWFKTICUSA-N
Literature Reference Author R.F.D.L.PRADILLA,M.TORTOSA
Literature Reference Citation ORG.LETTERS,6,2157(2004)
Literature Reference DOI 10.1021/ol049393n
Molecular Weight 278.409 g/mol
Sample ID 38870
Solvent CDCl3