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trans-1-methyl-4-isopropyl-2,3-di(methoxycarbonyl)-bicyclo[2.2.2]oct-5-ene
SpectraBase Compound ID 9VuT3x5Coga
InChI InChI=1S/C16H24O4/c1-10(2)16-8-6-15(3,7-9-16)11(13(17)19-4)12(16)14(18)20-5/h6,8,10-12H,7,9H2,1-5H3/t11-,12?,15-,16?/m0/s1
InChIKey UXJMNIRBJQQJJP-UUGHVDCASA-N
Mol Weight 280.36 g/mol
Molecular Formula C16H24O4
Exact Mass 280.167459 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 64YkNYuIFBo
Name trans-1-methyl-4-isopropyl-2,3-di(methoxycarbonyl)-bicyclo[2.2.2]oct-5-ene
CAS Registry Number 121824-68-8
Comments Less than 3 mono-isotopic peaks
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Formula C16H24O4
InChI InChI=1S/C16H24O4/c1-10(2)16-8-6-15(3,7-9-16)11(13(17)19-4)12(16)14(18)20-5/h6,8,10-12H,7,9H2,1-5H3/t11-,12?,15-,16?/m0/s1
InChIKey UXJMNIRBJQQJJP-UUGHVDCASA-N
Molecular Weight 280.364 g/mol
SMILES C12(C([C@](C(=O)OC)([H])[C@@](CC2)(C)C=C1)C(=O)OC)C(C)C
SPLASH splash10-0002-0900000000-ef3b9ec9d54479957659
Source of Spectrum O-24-39-0
Synonyms dimethyl (3R,4R)-1-isopropyl-4-methylbicyclo[2.2.2]oct-5-ene-2,3-dicarboxylate
Wiley ID 1283981