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(+-)-(1R,2S,2aR,5S)-Dimethyl 1,2-dimethyl-1,2,2a,5-tetrahydroacenaphthylene-2a,5-dicarboxylate
SpectraBase Compound ID 5PaFEPaKl88
InChI InChI=1S/C18H20O4/c1-10-11(2)18(17(20)22-4)9-8-14(16(19)21-3)13-7-5-6-12(10)15(13)18/h5-11,14H,1-4H3/t10-,11+,14+,18-/m1/s1
InChIKey MNJYIZPVPUYYFS-YSYLPMMESA-N
Mol Weight 300.35 g/mol
Molecular Formula C18H20O4
Exact Mass 300.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4NTCy6OTUt3
Name (+-)-(1R,2S,2aR,5S)-Dimethyl 1,2-dimethyl-1,2,2a,5-tetrahydroacenaphthylene-2a,5-dicarboxylate
Alternate Name(s) (+-)-(1R,2S,2aR,5S)-Dimethyl 3,6b,8,9a,9b-hexahydro-7H-cyclopenta[a]acenaphthylene-3,9b-dicarboxylate Dimethyl (1R,2S,2aR,5S)-1,2-dimethyl-1,2-dihydro-2a,5(5H)-acenaphthylenedicarboxylate (1R,2S,2aR,5S)-1,2-Dimethyl-1,2-dihydro-5H-acenaphthylene-2a,5-dicarboxylic acid dimethyl ester
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Formula C18H20O4
InChI InChI=1S/C18H20O4/c1-10-11(2)18(17(20)22-4)9-8-14(16(19)21-3)13-7-5-6-12(10)15(13)18/h5-11,14H,1-4H3/t10-,11+,14+,18-/m1/s1
InChIKey MNJYIZPVPUYYFS-YSYLPMMESA-N
Molecular Weight 300.354 g/mol
SMILES [C@@]12(c3c(cccc3[C@](C=C1)(C(=O)OC)[H])[C@@]([C@@]2(C)[H])(C)[H])C(=O)OC
SPLASH splash10-0a4i-9550000000-ace2d522452f01ee03d5
Source of Spectrum C-114-7662-8
Wiley ID 1303074