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BUTANE-1,2,4-TRIOL-2-HYDROCINNAMATE

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BUTANE-1,2,4-TRIOL-2-HYDROCINNAMATE
SpectraBase Compound ID H2ODmrc7MPc
InChI InChI=1S/C13H18O4/c14-9-8-12(10-15)17-13(16)7-6-11-4-2-1-3-5-11/h1-5,12,14-15H,6-10H2
InChIKey AEFRZDGZIUGODX-UHFFFAOYSA-N
Mol Weight 238.28 g/mol
Molecular Formula C13H18O4
Exact Mass 238.120509 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3CxPggL087s
Name BUTANE-1,2,4-TRIOL-2-HYDROCINNAMATE
Compound Number 19
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H18O4
InChI InChI=1S/C13H18O4/c14-9-8-12(10-15)17-13(16)7-6-11-4-2-1-3-5-11/h1-5,12,14-15H,6-10H2
InChIKey AEFRZDGZIUGODX-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 238.284 g/mol
Solvent CDCl3
Source File Reference UWLU27836