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Methyl 2-Acetoxy-4,6,6-trimethyl-bicyclo[2.2.2]octa-2,7-dien-5-one-7-carboxylate
SpectraBase Compound ID GXLXMWFvAg0
InChI InChI=1S/C15H18O5/c1-8(16)20-11-7-15(4)10(12(17)19-5)6-9(11)14(2,3)13(15)18/h6-7,9H,1-5H3/t9-,15-/m0/s1
InChIKey JTSDOQHETNFPCK-VFZGTOFNSA-N
Mol Weight 278.3 g/mol
Molecular Formula C15H18O5
Exact Mass 278.115424 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ABrZN7v4nYH
Name Methyl 2-Acetoxy-4,6,6-trimethyl-bicyclo[2.2.2]octa-2,7-dien-5-one-7-carboxylate
Alternate Name(s) Methyl 5-(acetyloxy)-1,8,8-trimethyl-7-oxobicyclo[2.2.2]octa-2,5-diene-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18O5
InChI InChI=1S/C15H18O5/c1-8(16)20-11-7-15(4)10(12(17)19-5)6-9(11)14(2,3)13(15)18/h6-7,9H,1-5H3/t9-,15-/m0/s1
InChIKey JTSDOQHETNFPCK-VFZGTOFNSA-N
Molecular Weight 278.304 g/mol
SMILES [C@@]12(C(=C[C@@](C(=C2)OC(=O)C)(C(C1=O)(C)C)[H])C(=O)OC)C
SPLASH splash10-00di-9100000000-aa6a77a330891c1c10ba
Source of Spectrum HE-1999-227-9
Wiley ID 1613424