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Diethyl 2-(((3R,4R)-6-(ethoxycarbonyl)-2-oxo-4-phenethyl-3,4-dihydro-2H-pyran-3-yl)methyl)malonate
SpectraBase Compound ID 9wx7AYPwjwr
InChI InChI=1S/C24H30O8/c1-4-29-21(25)19(22(26)30-5-2)15-18-17(13-12-16-10-8-7-9-11-16)14-20(32-23(18)27)24(28)31-6-3/h7-11,14,17-19H,4-6,12-13,15H2,1-3H3/t17-,18-/m1/s1
InChIKey GZOAGIBAPGBOIX-QZTJIDSGSA-N
Mol Weight 446.5 g/mol
Molecular Formula C24H30O8
Exact Mass 446.194068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7REXSl5fUsP
Name Diethyl 2-(((3R,4R)-6-(ethoxycarbonyl)-2-oxo-4-phenethyl-3,4-dihydro-2H-pyran-3-yl)methyl)malonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H30O8
InChI InChI=1S/C24H30O8/c1-4-29-21(25)19(22(26)30-5-2)15-18-17(13-12-16-10-8-7-9-11-16)14-20(32-23(18)27)24(28)31-6-3/h7-11,14,17-19H,4-6,12-13,15H2,1-3H3/t17-,18-/m1/s1
InChIKey GZOAGIBAPGBOIX-QZTJIDSGSA-N
Literature Reference DOI 10.1002/adsc.201700198
Molecular Weight 446.496 g/mol
SMILES C([C@@]1(C=C(OC([C@@]1(CC(C(OCC)=O)C(OCC)=O)[H])=O)C(=O)OCC)[H])Cc1ccccc1
SPLASH splash10-0006-9631100000-fa3aadef3e9226749c15
Source of Spectrum ASC-359-1678/SM21-6n
Wiley ID 1807585