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2H-1-Benzopyran-5-carboxylic acid, 3,4-dihydro-2-methyl-4-oxo-, methyl ester

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2H-1-Benzopyran-5-carboxylic acid, 3,4-dihydro-2-methyl-4-oxo-, methyl ester
SpectraBase Compound ID BARHcC6oXje
InChI InChI=1S/C12H12O4/c1-7-6-9(13)11-8(12(14)15-2)4-3-5-10(11)16-7/h3-5,7H,6H2,1-2H3
InChIKey LYGQFNPPSDCOOT-UHFFFAOYSA-N
Mol Weight 220.22 g/mol
Molecular Formula C12H12O4
Exact Mass 220.073559 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ChEvt1BpCMu
Name 2H-1-Benzopyran-5-carboxylic acid, 3,4-dihydro-2-methyl-4-oxo-, methyl ester
CAS Registry Number 120714-41-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12O4
InChI InChI=1S/C12H12O4/c1-7-6-9(13)11-8(12(14)15-2)4-3-5-10(11)16-7/h3-5,7H,6H2,1-2H3
InChIKey LYGQFNPPSDCOOT-UHFFFAOYSA-N
Molecular Weight 220.224 g/mol
SMILES c12C(CC(Oc2cccc1C(=O)OC)C)=O
SPLASH splash10-00di-1920000000-701dcdfcd37a6206eaec
Source of Spectrum B-41-548-12
Synonyms Methyl 2-methyl-4-oxo-3,4-dihydro-2H-benzopyran-5-carboxylate Methyl 2-methyl-4-oxo-5-chromanecarboxylate
Wiley ID 1219664