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1,4-dihydro-1-hydroxy-7-methyl-1-phenyl-2,3-naphthalenedicarboxylic acid, dimethyl ester
SpectraBase Compound ID 4cBDWOpSaVH
InChI InChI=1S/C21H20O5/c1-13-9-10-14-12-16(19(22)25-2)18(20(23)26-3)21(24,17(14)11-13)15-7-5-4-6-8-15/h4-11,24H,12H2,1-3H3
InChIKey CUMMLOWAXHWJCS-UHFFFAOYSA-N
Mol Weight 352.39 g/mol
Molecular Formula C21H20O5
Exact Mass 352.131074 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1e1NuOJS5ks
Name Dimethyl 1-hydroxy-7-methyl-1-phenyl-1,4-dihydro-2,3-naphthalenedicarboxylate
Alternate Name(s) 4-Hydroxy-6-methyl-4-phenyl-1H-naphthalene-2,3-dicarboxylic acid dimethyl ester Dimethyl 1-phenyl-7-methyl-1-hydroxy-1,4-dihydro-naphthalene-2,3-dicarboxylate Dimethyl 4-hydroxy-6-methyl-4-phenyl-1H-naphthalene-2,3-dicarboxylate Dimethyl 6-methyl-4-oxidanyl-4-phenyl-1H-naphthalene-2,3-dicarboxylate
CAS Registry Number 3405-01-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H20O5
InChI InChI=1S/C21H20O5/c1-13-9-10-14-12-16(19(22)25-2)18(20(23)26-3)21(24,17(14)11-13)15-7-5-4-6-8-15/h4-11,24H,12H2,1-3H3
InChIKey CUMMLOWAXHWJCS-UHFFFAOYSA-N
Molecular Weight 352.386 g/mol
SMILES OC1(c2ccccc2)c2cc(C)ccc2CC(=C1C(=O)OC)C(=O)OC
SPLASH splash10-004l-0291000000-95387f3bd2031f17f953
Source of Spectrum O-12-649-3
Wiley ID 1343360