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1,2-Naphthalenedicarboxylic acid, 1,5,6,7,8,8a-hexahydro-5,5-dimethyl-, dimethyl ester, trans-(.+-.)-
SpectraBase Compound ID 1hPl1Uf4rUe
InChI InChI=1S/C16H22O4/c1-16(2)9-5-6-10-12(16)8-7-11(14(17)19-3)13(10)15(18)20-4/h7-8,10,13H,5-6,9H2,1-4H3/t10-,13-/m1/s1
InChIKey JAEBVPKJQWUINW-ZWNOBZJWSA-N
Mol Weight 278.35 g/mol
Molecular Formula C16H22O4
Exact Mass 278.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KKKDlOhIWdg
Name 1,2-Naphthalenedicarboxylic acid, 1,5,6,7,8,8a-hexahydro-5,5-dimethyl-, dimethyl ester, trans-(.+-.)-
CAS Registry Number 130487-12-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22O4
InChI InChI=1S/C16H22O4/c1-16(2)9-5-6-10-12(16)8-7-11(14(17)19-3)13(10)15(18)20-4/h7-8,10,13H,5-6,9H2,1-4H3/t10-,13-/m1/s1
InChIKey JAEBVPKJQWUINW-ZWNOBZJWSA-N
Molecular Weight 278.348 g/mol
SMILES C1=2[C@]([C@@](C(=O)OC)(C(=CC2)C(=O)OC)[H])(CCCC1(C)C)[H]
SPLASH splash10-0671-1960000000-0097bb49319ae6135a73
Source of Spectrum H-73-649-25
Synonyms Dimethyl (1R,8aS)-5,5-dimethyl-1,5,6,7,8,8a-hexahydro-1,2-naphthalenedicarboxylate Dimethyl(4aRS,5RS)-1,2,3,4,4a,5-hexahydro-1,1-dimethylnaphthalene-5,6-dicarboxylate
Wiley ID 1282071