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1,2-Naphthalenedicarboxylic acid, decahydro-5,5,8a-trimethyl-, dimethyl ester, (1.alpha.,2.alpha.,4a.beta.,8a.alpha.)-(.+-.)-

View entire compound with spectra: 1 MS (GC)

1,2-Naphthalenedicarboxylic acid, decahydro-5,5,8a-trimethyl-, dimethyl ester, (1.alpha.,2.alpha.,4a.beta.,8a.alpha.)-(.+-.)-
SpectraBase Compound ID CUYyX7GpMJp
InChI InChI=1S/C17H28O4/c1-16(2)9-6-10-17(3)12(16)8-7-11(14(18)20-4)13(17)15(19)21-5/h11-13H,6-10H2,1-5H3/t11-,12-,13+,17-/m1/s1
InChIKey PVFJLVPBDYSZKW-KOFHJDLBSA-N
Mol Weight 296.41 g/mol
Molecular Formula C17H28O4
Exact Mass 296.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LK0PSgTgXks
Name 1,2-Naphthalenedicarboxylic acid, decahydro-5,5,8a-trimethyl-, dimethyl ester, (1.alpha.,2.alpha.,4a.beta.,8a.alpha.)-(.+-.)-
Alternate Name(s) Dimethyl (1R,2R,4aR,8aR)-5,5,8a-trimethyldecahydro-1,2-naphthalenedicarboxylate Dimethyl (1RS,2RS,4aRS)-1,2,3,4,4a,5,6,7,8,8a-decahydro-5,5,8a-trimethylnaphthalene-1,2-dicarboxylate
CAS Registry Number 86558-62-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H28O4
InChI InChI=1S/C17H28O4/c1-16(2)9-6-10-17(3)12(16)8-7-11(14(18)20-4)13(17)15(19)21-5/h11-13H,6-10H2,1-5H3/t11-,12-,13+,17-/m1/s1
InChIKey PVFJLVPBDYSZKW-KOFHJDLBSA-N
Molecular Weight 296.407 g/mol
SMILES [C@]12([C@@]([C@](C(=O)OC)(CC[C@@]2(C(C)(C)CCC1)[H])[H])(C(=O)OC)[H])C
SPLASH splash10-0ck9-7900000000-61b517c62516f7bc6d8f
Source of Spectrum H-73-650-42
Wiley ID 1299195