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1,3-Benzenediol, o-(3-methylbut-2-enoyl)-o'-(3-phenylpropionyl)-
SpectraBase Compound ID Iw2d9cdO8Ii
InChI InChI=1S/C20H20O4/c1-15(2)13-20(22)24-18-10-6-9-17(14-18)23-19(21)12-11-16-7-4-3-5-8-16/h3-10,13-14H,11-12H2,1-2H3
InChIKey VIJFLUMPKBMKDW-UHFFFAOYSA-N
Mol Weight 324.38 g/mol
Molecular Formula C20H20O4
Exact Mass 324.136159 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JXJXT6K8m2
Name 1,3-Benzenediol, o-(3-methylbut-2-enoyl)-o'-(3-phenylpropionyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 324.136159120 u
Formula C20H20O4
InChI InChI=1S/C20H20O4/c1-15(2)13-20(22)24-18-10-6-9-17(14-18)23-19(21)12-11-16-7-4-3-5-8-16/h3-10,13-14H,11-12H2,1-2H3
InChIKey VIJFLUMPKBMKDW-UHFFFAOYSA-N
Molecular Weight 324.376 g/mol
SMILES C1=C(C=CC=C1OC(=O)C=C(C)C)OC(=O)CCC1=CC=CC=C1