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1-Methoxy-6-(methoxycarbonyl)-6-[2-(2-carbomethoxyvinyl)benzyl]-1,4-cyclohexadiene
SpectraBase Compound ID 1NEKHXSMmGR
InChI InChI=1S/C20H22O5/c1-23-17-10-6-7-13-20(17,19(22)25-3)14-16-9-5-4-8-15(16)11-12-18(21)24-2/h4-5,7-13H,6,14H2,1-3H3/b12-11+
InChIKey HWZPSYOKEMCHCX-VAWYXSNFSA-N
Mol Weight 342.39 g/mol
Molecular Formula C20H22O5
Exact Mass 342.146724 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EWlsxjTQgJI
Name 1-Methoxy-6-(methoxycarbonyl)-6-[2-(2-carbomethoxyvinyl)benzyl]-1,4-cyclohexadiene
CAS Registry Number 97253-92-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22O5
InChI InChI=1S/C20H22O5/c1-23-17-10-6-7-13-20(17,19(22)25-3)14-16-9-5-4-8-15(16)11-12-18(21)24-2/h4-5,7-13H,6,14H2,1-3H3/b12-11+
InChIKey HWZPSYOKEMCHCX-VAWYXSNFSA-N
Molecular Weight 342.391 g/mol
SMILES C1(Cc2c(\C=C\C(=O)OC)cccc2)(C(=O)OC)C(=CCC=C1)OC
SPLASH splash10-000i-4900000000-bfb12a47649c786a39a0
Source of Spectrum J-50-3088-1
Synonyms Methyl 2-methoxy-1-{2-[(1E)-3-methoxy-3-oxo-1-propenyl]benzyl}-2,5-cyclohexadiene-1-carboxylate
Wiley ID 1336657