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2,3-Naphthalenedicarboxylic acid, 1,2,3,4-tetrahydro-1-phenyl-, dimethyl ester, (1.alpha.,2.beta.,3.beta.)-(.+-.)-
SpectraBase Compound ID DX324COq5Hc
InChI InChI=1S/C20H20O4/c1-23-19(21)16-12-14-10-6-7-11-15(14)17(18(16)20(22)24-2)13-8-4-3-5-9-13/h3-11,16-18H,12H2,1-2H3/t16-,17-,18-/m0/s1
InChIKey NULZFBYAAAVEJZ-BZSNNMDCSA-N
Mol Weight 324.38 g/mol
Molecular Formula C20H20O4
Exact Mass 324.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GJEXndKsLYQ
Name 2,3-Naphthalenedicarboxylic acid, 1,2,3,4-tetrahydro-1-phenyl-, dimethyl ester, (1.alpha.,2.beta.,3.beta.)-(.+-.)-
CAS Registry Number 98678-39-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20O4
InChI InChI=1S/C20H20O4/c1-23-19(21)16-12-14-10-6-7-11-15(14)17(18(16)20(22)24-2)13-8-4-3-5-9-13/h3-11,16-18H,12H2,1-2H3/t16-,17-,18-/m0/s1
InChIKey NULZFBYAAAVEJZ-BZSNNMDCSA-N
Molecular Weight 324.376 g/mol
SMILES [C@]1([C@](Cc2c([C@@]1(c1ccccc1)[H])cccc2)(C(=O)OC)[H])(C(=O)OC)[H]
SPLASH splash10-0a4i-0090000000-621dfbcf6f2dd6fc8dba
Source of Spectrum J-50-4833-21
Synonyms Dimethyl (1S,2R,3S)-1-phenyl-1,2,3,4-tetrahydro-2,3-naphthalenedicarboxylate (1S,2R,3S)-1-phenyl-1,2,3,4-tetrahydronaphthalene-2,3-dicarboxylic acid dimethyl ester Dimethyl (1S,2R,3S)-1-phenyltetralin-2,3-dicarboxylate Dimethyl (1S,2R,3S)-1-phenyl-1,2,3,4-tetrahydronaphthalene-2,3-dicarboxylate
Wiley ID 1323437