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(R,S)-1,2-O-ISOPROPYLIDENE-4-O-BENZYLBUTANE-1,2,4-TRIOL
SpectraBase Compound ID 9ywUnUPmkK1
InChI InChI=1S/C14H20O3/c1-14(2)16-11-13(17-14)8-9-15-10-12-6-4-3-5-7-12/h3-7,13H,8-11H2,1-2H3
InChIKey PQMIOFVDDSZEEA-UHFFFAOYSA-N
Mol Weight 236.31 g/mol
Molecular Formula C14H20O3
Exact Mass 236.141245 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6DmHyzgBTlQ
Name (R,S)-1,2-O-ISOPROPYLIDENE-4-O-BENZYLBUTANE-1,2,4-TRIOL
Compound Number 14B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H20O3
InChI InChI=1S/C14H20O3/c1-14(2)16-11-13(17-14)8-9-15-10-12-6-4-3-5-7-12/h3-7,13H,8-11H2,1-2H3
InChIKey PQMIOFVDDSZEEA-UHFFFAOYSA-N
Literature Reference Author T.BEUERLE,S.ENGELHARD,C.BICCHI,W.SCHWAB
Literature Reference Citation J.NAT.PROD.,62,35(1999)
Literature Reference DOI 10.1021/np980094e
Molecular Weight 236.311 g/mol
Solvent CDCl3
Source File Reference UWCS19782