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Diethyl 2-(((3R,4R)-6-(methoxycarbonyl)-4-(4-methoxyphenyl)-2-oxo-3,4-dihydro-2H-pyran-3-yl)methyl)malonate
SpectraBase Compound ID HDP5aMD4jG5
InChI InChI=1S/C22H26O9/c1-5-29-19(23)17(20(24)30-6-2)11-16-15(13-7-9-14(27-3)10-8-13)12-18(22(26)28-4)31-21(16)25/h7-10,12,15-17H,5-6,11H2,1-4H3/t15-,16+/m0/s1
InChIKey MBKPTOUKULGOBA-JKSUJKDBSA-N
Mol Weight 434.44 g/mol
Molecular Formula C22H26O9
Exact Mass 434.157682 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1lI7MbFzFmU
Name Diethyl 2-(((3R,4R)-6-(methoxycarbonyl)-4-(4-methoxyphenyl)-2-oxo-3,4-dihydro-2H-pyran-3-yl)methyl)malonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H26O9
InChI InChI=1S/C22H26O9/c1-5-29-19(23)17(20(24)30-6-2)11-16-15(13-7-9-14(27-3)10-8-13)12-18(22(26)28-4)31-21(16)25/h7-10,12,15-17H,5-6,11H2,1-4H3/t15-,16+/m0/s1
InChIKey MBKPTOUKULGOBA-JKSUJKDBSA-N
Literature Reference DOI 10.1002/adsc.201700198
Molecular Weight 434.441 g/mol
SMILES c1cc(ccc1OC)[C@@]1(C=C(OC([C@@]1(CC(C(OCC)=O)C(OCC)=O)[H])=O)C(=O)OC)[H]
SPLASH splash10-03di-0910000000-ee9b0b3adb9eeed39cf4
Source of Spectrum ASC-359-1678/SM17-6d
Wiley ID 1807573