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di-(Isopropyl) 2-[4'-(benzyloxy)-3'-methoxybenzyl]-3-hydroxybutanedioate
SpectraBase Compound ID DaODrQjpLQ4
InChI InChI=1S/C25H32O7/c1-16(2)31-24(27)20(23(26)25(28)32-17(3)4)13-19-11-12-21(22(14-19)29-5)30-15-18-9-7-6-8-10-18/h6-12,14,16-17,20,23,26H,13,15H2,1-5H3
InChIKey SFDIAWFLLPKTQT-UHFFFAOYSA-N
Mol Weight 444.5 g/mol
Molecular Formula C25H32O7
Exact Mass 444.214803 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3A3yQqUmlOf
Name di-(Isopropyl) 2-[4'-(benzyloxy)-3'-methoxybenzyl]-3-hydroxybutanedioate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H32O7
InChI InChI=1S/C25H32O7/c1-16(2)31-24(27)20(23(26)25(28)32-17(3)4)13-19-11-12-21(22(14-19)29-5)30-15-18-9-7-6-8-10-18/h6-12,14,16-17,20,23,26H,13,15H2,1-5H3
InChIKey SFDIAWFLLPKTQT-UHFFFAOYSA-N
Molecular Weight 444.524 g/mol
SMILES OC(C(OC(C)C)=O)C(C(OC(C)C)=O)Cc1cc(OC)c(cc1)OCc1ccccc1
SPLASH splash10-0006-2031900000-13e623868834755cef04
Source of Spectrum H-85-4226-9
Synonyms Diisopropyl 2-[4'-(benzyloxy)-3'-methoxybenzyl]-3-hydroxybutane-1,4-dioate diisopropyl 2-[4-(benzyloxy)-3-methoxybenzyl]-3-hydroxysuccinate
Wiley ID 1524866