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Diethyl 4,4-bis(4'-hydroxy-3',5'-dimethylphenyl)heptanedioatee
SpectraBase Compound ID BxpkG5S7nAK
InChI InChI=1S/C27H36O6/c1-7-32-23(28)9-11-27(12-10-24(29)33-8-2,21-13-17(3)25(30)18(4)14-21)22-15-19(5)26(31)20(6)16-22/h13-16,30-31H,7-12H2,1-6H3
InChIKey TXKQHUWPHYENIS-UHFFFAOYSA-N
Mol Weight 456.6 g/mol
Molecular Formula C27H36O6
Exact Mass 456.251189 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dfgve47VAuY
Name Diethyl 4,4-bis(4'-hydroxy-3',5'-dimethylphenyl)heptanedioatee
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H36O6
InChI InChI=1S/C27H36O6/c1-7-32-23(28)9-11-27(12-10-24(29)33-8-2,21-13-17(3)25(30)18(4)14-21)22-15-19(5)26(31)20(6)16-22/h13-16,30-31H,7-12H2,1-6H3
InChIKey TXKQHUWPHYENIS-UHFFFAOYSA-N
Molecular Weight 456.579 g/mol
SMILES Oc1c(cc(C(c2cc(c(c(c2)C)O)C)(CCC(=O)OCC)CCC(=O)OCC)cc1C)C
SPLASH splash10-0a4i-0009100000-594ce01f83595e531a2e
Source of Spectrum H-82-1089-28
Wiley ID 815423