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Diethyl 2-(((3R,4R)-4-(benzo[d][1,3]dioxol-5-yl)-6-(methoxycarbonyl)-2-oxo-3,4-dihydro-2H-pyran-3-yl)methyl)malonate
SpectraBase Compound ID KYfycQ6t1QW
InChI InChI=1S/C22H24O10/c1-4-28-19(23)15(20(24)29-5-2)9-14-13(10-18(22(26)27-3)32-21(14)25)12-6-7-16-17(8-12)31-11-30-16/h6-8,10,13-15H,4-5,9,11H2,1-3H3/t13-,14+/m0/s1
InChIKey SYSHKTQCOBESER-UONOGXRCSA-N
Mol Weight 448.42 g/mol
Molecular Formula C22H24O10
Exact Mass 448.136947 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lrrk3waX7bE
Name Diethyl 2-(((3R,4R)-4-(benzo[d][1,3]dioxol-5-yl)-6-(methoxycarbonyl)-2-oxo-3,4-dihydro-2H-pyran-3-yl)methyl)malonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H24O10
InChI InChI=1S/C22H24O10/c1-4-28-19(23)15(20(24)29-5-2)9-14-13(10-18(22(26)27-3)32-21(14)25)12-6-7-16-17(8-12)31-11-30-16/h6-8,10,13-15H,4-5,9,11H2,1-3H3/t13-,14+/m0/s1
InChIKey SYSHKTQCOBESER-UONOGXRCSA-N
Literature Reference DOI 10.1002/adsc.201700198
Molecular Weight 448.424 g/mol
SMILES c12cc(ccc2OCO1)[C@@]1(C=C(OC([C@@]1(CC(C(OCC)=O)C(OCC)=O)[H])=O)C(=O)OC)[H]
SPLASH splash10-0fbi-1694100000-bc6354be5cb5d7c77945
Source of Spectrum ASC-359-1678/SM18-6h
Wiley ID 1807577