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2-Oxabicyclo[3.3.1]non-6-ene-4-carboxylic acid, 6,7-dimethyl-3-oxo-, methyl ester, exo-
SpectraBase Compound ID BZKjrBY3q1V
InChI InChI=1S/C12H16O4/c1-6-4-8-5-9(7(6)2)10(11(13)15-3)12(14)16-8/h8-10H,4-5H2,1-3H3
InChIKey RAQBUVDSTOMNAW-UHFFFAOYSA-N
Mol Weight 224.26 g/mol
Molecular Formula C12H16O4
Exact Mass 224.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4hiFcVS8d8k
Name 2-Oxabicyclo[3.3.1]non-6-ene-4-carboxylic acid, 6,7-dimethyl-3-oxo-, methyl ester, exo-
Alternate Name(s) 4-exo-carbomethoxy-6,7-dimethyl-2-oxabicyclo[3.3.1]non-6-en-3-one Methyl 6,7-dimethyl-3-oxo-2-oxabicyclo[3.3.1]non-6-ene-4-carboxylate
CAS Registry Number 118658-20-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O4
InChI InChI=1S/C12H16O4/c1-6-4-8-5-9(7(6)2)10(11(13)15-3)12(14)16-8/h8-10H,4-5H2,1-3H3
InChIKey RAQBUVDSTOMNAW-UHFFFAOYSA-N
Molecular Weight 224.256 g/mol
SMILES C1(C(C2C(C)=C(CC(O1)C2)C)C(=O)OC)=O
SPLASH splash10-0a4i-7900000000-82ce5090a0cfb89e6513
Source of Spectrum J-54-1116-13
Wiley ID 1224997