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(2RS)-9-Oxo-8-oxa-bicyclo(4.3.0)non-1(6)-ene-2-carboxylic acid, methyl ester

View entire compound with spectra: 1 NMR, and 1 MS (GC)

(2RS)-9-Oxo-8-oxa-bicyclo(4.3.0)non-1(6)-ene-2-carboxylic acid, methyl ester
SpectraBase Compound ID E0uhfQNrLWF
InChI InChI=1S/C10H12O4/c1-13-9(11)7-4-2-3-6-5-14-10(12)8(6)7/h7H,2-5H2,1H3
InChIKey KRRDXXOOFDGXSO-UHFFFAOYSA-N
Mol Weight 196.2 g/mol
Molecular Formula C10H12O4
Exact Mass 196.073559 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4owOrsH59fn
Name Methyl (7R)-1-oxo-(hexahydro)-isobenzofuran-7-carboxylate
Alternate Name(s) Methyl 3-oxo-1,3,4,5,6,7-hexahydro-2-benzofuran-4-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12O4
InChI InChI=1S/C10H12O4/c1-13-9(11)7-4-2-3-6-5-14-10(12)8(6)7/h7H,2-5H2,1H3
InChIKey KRRDXXOOFDGXSO-UHFFFAOYSA-N
Molecular Weight 196.202 g/mol
SMILES C1=2C(OCC2CCCC1C(=O)OC)=O
SPLASH splash10-0006-9700000000-56a3dc33e32fb9b5afb1
Source of Spectrum U1-2003-4066-18
Wiley ID 1523867