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Methyl 6-Methyl-7-tert-butoxy-4-acetoxy-3-oxobicyclo[4.3.0]non-1-en-2-carboxylate isomer
SpectraBase Compound ID L8lwE6SI6Vf
InChI InChI=1S/C18H26O7/c1-9(19)24-11-8-18(5)12(25-17(2,3)4)7-10(20)14(18)13(15(11)21)16(22)23-6/h10-12,20H,7-8H2,1-6H3/t10?,11-,12?,18-/m1/s1
InChIKey UZIIDBCVGHGJSQ-INZWOEBDSA-N
Mol Weight 354.4 g/mol
Molecular Formula C18H26O7
Exact Mass 354.167853 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5pDcNnmrutq
Name Methyl 6-Methyl-7-tert-butoxy-4-acetoxy-3-oxobicyclo[4.3.0]non-1-en-2-carboxylate isomer
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Formula C18H26O7
InChI InChI=1S/C18H26O7/c1-9(19)24-11-8-18(5)12(25-17(2,3)4)7-10(20)14(18)13(15(11)21)16(22)23-6/h10-12,20H,7-8H2,1-6H3/t10?,11-,12?,18-/m1/s1
InChIKey UZIIDBCVGHGJSQ-INZWOEBDSA-N
Molecular Weight 354.399 g/mol
SMILES OC1C2=C(C([C@@](C[C@@]2(C(OC(C)(C)C)C1)C)(OC(=O)C)[H])=O)C(=O)OC
SPLASH splash10-0bvi-1950000000-e9b24db569a1a8d5bce2
Source of Spectrum F-50-8419-71
Synonyms (6R,7aS)-6-Acetoxy-1-tert-butoxy-3-hydroxy-7a-methyl-5-oxo-2,3,5,6,7,7a-hexahydro-1H-indene-4-carboxylic acid methyl ester
Wiley ID 1344453