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(E)-ethyl 6-(benzo[d][1,3]dioxol-6-yl)-2-ethyl-5-methyl-3,4-dioxohex-5-enoate
SpectraBase Compound ID 21YFnxMN2QT
InChI InChI=1S/C18H20O6/c1-4-13(18(21)22-5-2)17(20)16(19)11(3)8-12-6-7-14-15(9-12)24-10-23-14/h6-9,13H,4-5,10H2,1-3H3/b11-8+
InChIKey SHWQKSKXILEEJL-DHZHZOJOSA-N
Mol Weight 332.35 g/mol
Molecular Formula C18H20O6
Exact Mass 332.125988 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 752JmjTYfYU
Name (E)-ethyl 6-(benzo[d][1,3]dioxol-6-yl)-2-ethyl-5-methyl-3,4-dioxohex-5-enoate
Alternate Name(s) Ethyl (E)-6-(benzo[d][1,3]dioxol-5-yl)-2-ethyl-5-methyl-3,4-dioxohex-5-enoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20O6
InChI InChI=1S/C18H20O6/c1-4-13(18(21)22-5-2)17(20)16(19)11(3)8-12-6-7-14-15(9-12)24-10-23-14/h6-9,13H,4-5,10H2,1-3H3/b11-8+
InChIKey SHWQKSKXILEEJL-DHZHZOJOSA-N
Literature Reference DOI 10.1002/anie.201201724
Molecular Weight 332.352 g/mol
SMILES C(\C(=C\c1ccc2c(c1)OCO2)C)(=O)C(=O)C(CC)C(=O)OCC
SPLASH splash10-052r-0901000000-c67de6560fe315752184
Source of Spectrum ACI-51-SMS18-D_8
Wiley ID 1780318