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Dimethyl 4-((e)-cinnamoyl)-4-cyclohexene-1,2-dicarboxylate
SpectraBase Compound ID BIwlEQQ8eUU
InChI InChI=1S/C19H20O5/c1-23-18(21)15-10-9-14(12-16(15)19(22)24-2)17(20)11-8-13-6-4-3-5-7-13/h3-9,11,15-16H,10,12H2,1-2H3
InChIKey OTYBPIKOUDCLHE-UHFFFAOYSA-N
Mol Weight 328.36 g/mol
Molecular Formula C19H20O5
Exact Mass 328.131074 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2sBUbd9HoO
Name Dimethyl trans-4-((e)-cinnamoyl)-4-cyclohexene-1,2-dicarboxylate
Alternate Name(s) Dimethyl (1s,2s)-4-((e)-cinnamoyl)-4-cyclohexene-1,2-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H20O5
InChI InChI=1S/C19H20O5/c1-23-18(21)15-10-9-14(12-16(15)19(22)24-2)17(20)11-8-13-6-4-3-5-7-13/h3-9,11,15-16H,10,12H2,1-2H3
InChIKey OTYBPIKOUDCLHE-UHFFFAOYSA-N
Ionization Type EI-B
Molecular Weight 328.364 g/mol
SMILES COC(=O)C1CC=C(CC1C(=O)OC)C(=O)C=Cc1ccccc1
SPLASH splash10-0a7j-2590000000-10c7ef98674432e666cd
Source of Spectrum SRH-2022-10254-0
Wiley ID 1831875