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2-METHYLBUTANE-1,2,4-TRIOL-1-HYDROCINNAMATE

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2-METHYLBUTANE-1,2,4-TRIOL-1-HYDROCINNAMATE
SpectraBase Compound ID 6sd0tsQyIHs
InChI InChI=1S/C14H20O4/c1-14(17,9-10-15)11-18-13(16)8-7-12-5-3-2-4-6-12/h2-6,15,17H,7-11H2,1H3
InChIKey ZVDNSQWHIUMKTR-UHFFFAOYSA-N
Mol Weight 252.31 g/mol
Molecular Formula C14H20O4
Exact Mass 252.136159 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BGX0xrHzeeQ
Name 2-METHYLBUTANE-1,2,4-TRIOL-1-HYDROCINNAMATE
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H20O4
InChI InChI=1S/C14H20O4/c1-14(17,9-10-15)11-18-13(16)8-7-12-5-3-2-4-6-12/h2-6,15,17H,7-11H2,1H3
InChIKey ZVDNSQWHIUMKTR-UHFFFAOYSA-N
Literature Reference Author J.L.GINER,X.LI,J.J.MULLINS
Literature Reference Citation J.ORG.CHEM.,68,10079(2003)
Literature Reference DOI 10.1021/jo034566s
Molecular Weight 252.310 g/mol
Solvent CDCl3
Source File Reference UWLU27832