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2,3-Naphthalenedicarboxylic acid, 1,2,3,4-tetrahydro-1,4-dimethyl-, dimethyl ester, (1.alpha.,2.alpha.,3.beta.,4.alpha.)-

View entire compound with spectra: 2 MS (GC)

2,3-Naphthalenedicarboxylic acid, 1,2,3,4-tetrahydro-1,4-dimethyl-, dimethyl ester, (1.alpha.,2.alpha.,3.beta.,4.alpha.)-
SpectraBase Compound ID 2VrJ3UyTV3K
InChI InChI=1S/C16H20O4/c1-9-11-7-5-6-8-12(11)10(2)14(16(18)20-4)13(9)15(17)19-3/h5-10,13-14H,1-4H3/t9-,10+,13-,14-/m1/s1
InChIKey NGWBGEANRDTDCK-RDBQEKCUSA-N
Mol Weight 276.33 g/mol
Molecular Formula C16H20O4
Exact Mass 276.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JzIsyNKKv40
Name 2,3-Naphthalenedicarboxylic acid, 1,2,3,4-tetrahydro-1,4-dimethyl-, dimethyl ester, (1.alpha.,2.alpha.,3.beta.,4.alpha.)-
CAS Registry Number 83781-78-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20O4
InChI InChI=1S/C16H20O4/c1-9-11-7-5-6-8-12(11)10(2)14(16(18)20-4)13(9)15(17)19-3/h5-10,13-14H,1-4H3/t9-,10+,13-,14-/m1/s1
InChIKey NGWBGEANRDTDCK-RDBQEKCUSA-N
Molecular Weight 276.332 g/mol
SMILES [C@]1([C@@]([C@@](C)(c2c([C@]1(C)[H])cccc2)[H])(C(=O)OC)[H])(C(=O)OC)[H]
SPLASH splash10-05mo-0920000000-76f6c495c3b4c1a8d0d1
Source of Spectrum C-104-7619-0
Synonyms endo-all-cis- and exo-(1.alpha.,2.beta.,3.beta.,4.alpha.)-2,3-Dicarbomethoxy-1,4-dimethyl-1,2,3,4-tetrahydronaphthalene (1.beta.,2.beta.,3.alpha.,4.beta.)-2,3-dicarbomethoxy-1,4-dimethyl-1,2,3,4-tetrahydronaphthalene Dimethyl (1R,2R,3R,4S)-1,4-dimethyl-1,2,3,4-tetrahydro-2,3-naphthalenedicarboxylate
Wiley ID 1280144