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Butanedioic acid, 2,3-bis(1,3-benzodioxol-5-ylcarbonyl)-, diethyl ester, (R*,R*)-(.+-.)-
SpectraBase Compound ID 6rNKsEgp9Hb
InChI InChI=1S/C24H22O10/c1-3-29-23(27)19(21(25)13-5-7-15-17(9-13)33-11-31-15)20(24(28)30-4-2)22(26)14-6-8-16-18(10-14)34-12-32-16/h5-10,19-20H,3-4,11-12H2,1-2H3/t19-,20-/m1/s1
InChIKey MGVXXSVYHTWMQY-WOJBJXKFSA-N
Mol Weight 470.43 g/mol
Molecular Formula C24H22O10
Exact Mass 470.121297 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J7pInFLxN0R
Name Butanedioic acid, 2,3-bis(1,3-benzodioxol-5-ylcarbonyl)-, diethyl ester, (R*,R*)-(.+-.)-
Alternate Name(s) Diethyl (2R,3R)-2,3-bis(1,3-benzodioxol-5-ylcarbonyl)butanedioate Erythro-diethyl 2,3-bis-(3,4-methylenedioxybenzoyl)butane-1,4-dioate
CAS Registry Number 81581-31-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H22O10
InChI InChI=1S/C24H22O10/c1-3-29-23(27)19(21(25)13-5-7-15-17(9-13)33-11-31-15)20(24(28)30-4-2)22(26)14-6-8-16-18(10-14)34-12-32-16/h5-10,19-20H,3-4,11-12H2,1-2H3/t19-,20-/m1/s1
InChIKey MGVXXSVYHTWMQY-WOJBJXKFSA-N
Molecular Weight 470.430 g/mol
SMILES [C@]([C@](C(c1cc2OCOc2cc1)=O)(C(=O)OCC)[H])(C(c1cc2OCOc2cc1)=O)(C(=O)OCC)[H]
SPLASH splash10-0002-0900000000-1b671164749185efe30b
Source of Spectrum KC-1982-188-0
Wiley ID 1392770