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(S)-1,2-O-3-PENTYLIDENE-1,2,4-BUTANETRIOL
SpectraBase Compound ID E8LNr7BGZBM
InChI InChI=1S/C9H18O3/c1-3-9(4-2)11-7-8(12-9)5-6-10/h8,10H,3-7H2,1-2H3/t8-/m1/s1
InChIKey ZFLMDSXNYOCQST-MRVPVSSYSA-N
Mol Weight 174.24 g/mol
Molecular Formula C9H18O3
Exact Mass 174.125594 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LhsyFVu9Nxu
Name (S)-1,2-O-3-PENTYLIDENE-1,2,4-BUTANETRIOL
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H18O3
InChI InChI=1S/C9H18O3/c1-3-9(4-2)11-7-8(12-9)5-6-10/h8,10H,3-7H2,1-2H3/t8-/m1/s1
InChIKey ZFLMDSXNYOCQST-MRVPVSSYSA-N
Literature Reference Author L.BOERJESSON,I.CSOEREGH,C.J.WELCH
Literature Reference Citation J.ORG.CHEM.,60,2989(1995)
Literature Reference DOI 10.1021/jo00115a013
Molecular Weight 174.240 g/mol
Solvent CDCl3
Source File Reference UWGE475