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1H-Indene-5,6-dicarboxylic acid, 2,3,4,5,6,7-hexahydro-1,1-dimethyl-3-oxo-, dimethyl ester, cis-
SpectraBase Compound ID 5SLbzkYa1Gs
InChI InChI=1S/C15H20O5/c1-15(2)7-12(16)10-5-8(13(17)19-3)9(6-11(10)15)14(18)20-4/h8-9H,5-7H2,1-4H3/t8-,9+/m0/s1
InChIKey PZZYXESBDRVCNH-DTWKUNHWSA-N
Mol Weight 280.32 g/mol
Molecular Formula C15H20O5
Exact Mass 280.131074 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4QZKqSBAPRz
Name Dimethyl cis-3,3-dimethyl-2,3,4,5,6,7-hexahydroinden-1(h)-one-5,6-dicarboxylate
Alternate Name(s) Dimethyl (5r,6s)-3,3-dimethyl-2,3,4,5,6,7-hexahydroinden-1(h)-one-5,6-dicarboxylate
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Formula C15H20O5
InChI InChI=1S/C15H20O5/c1-15(2)7-12(16)10-5-8(13(17)19-3)9(6-11(10)15)14(18)20-4/h8-9H,5-7H2,1-4H3/t8-,9+/m0/s1
InChIKey PZZYXESBDRVCNH-DTWKUNHWSA-N
Ionization Type EI-B
Molecular Weight 280.320 g/mol
SMILES COC(=O)[C@]1(CC2=C(C[C@]1(C(=O)OC)[H])C(C)(C)CC2=O)[H]
SPLASH splash10-00dl-5950000000-af16a600a75ed08729c3
Source of Spectrum SRH-2022-10249-0
Wiley ID 1831870