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Dimethyl (2RS)-2-({(2E)-3-[3,4-Bis(acetyloxy)phenyl]prop-2-enoyl}oxy)pentanedioate
SpectraBase Compound ID FF9YdwQpFJz
InChI InChI=1S/C20H22O10/c1-12(21)28-15-7-5-14(11-17(15)29-13(2)22)6-9-19(24)30-16(20(25)27-4)8-10-18(23)26-3/h5-7,9,11,16H,8,10H2,1-4H3/b9-6+
InChIKey UXWNINIYHRIBCS-RMKNXTFCSA-N
Mol Weight 422.39 g/mol
Molecular Formula C20H22O10
Exact Mass 422.121297 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1P4RojMFi4b
Name Dimethyl (2RS)-2-({(2E)-3-[3,4-Bis(acetyloxy)phenyl]prop-2-enoyl}oxy)pentanedioate
Alternate Name(s) (E)-dimethyl 2-((3-(3,4-diacetoxyphenyl)acryloyl)oxy)pentanedioate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22O10
InChI InChI=1S/C20H22O10/c1-12(21)28-15-7-5-14(11-17(15)29-13(2)22)6-9-19(24)30-16(20(25)27-4)8-10-18(23)26-3/h5-7,9,11,16H,8,10H2,1-4H3/b9-6+
InChIKey UXWNINIYHRIBCS-RMKNXTFCSA-N
Literature Reference DOI 10.1002/cbdv.201200424
Molecular Weight 422.386 g/mol
SMILES C(C(CCC(=O)OC)OC(\C=C\c1cc(c(cc1)OC(=O)C)OC(=O)C)=O)(=O)OC
SPLASH splash10-03di-0913000000-ece86876bb8a8c0fdda5
Source of Spectrum CBD-10-1719-6
Wiley ID 1771216