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2H-1-Benzopyran-4a(5H)-carboxylic acid, 8,8a-dihydro-6,7-dimethyl-2-oxo-, methyl ester
SpectraBase Compound ID F26qEjpUlKA
InChI InChI=1S/C13H16O4/c1-8-6-10-13(7-9(8)2,12(15)16-3)5-4-11(14)17-10/h4-5,10H,6-7H2,1-3H3
InChIKey UGMLJEWZUROELD-UHFFFAOYSA-N
Mol Weight 236.27 g/mol
Molecular Formula C13H16O4
Exact Mass 236.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2vj0Ae6hqWL
Name 2H-1-Benzopyran-4a(5H)-carboxylic acid, 8,8a-dihydro-6,7-dimethyl-2-oxo-, methyl ester
CAS Registry Number 37464-24-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O4
InChI InChI=1S/C13H16O4/c1-8-6-10-13(7-9(8)2,12(15)16-3)5-4-11(14)17-10/h4-5,10H,6-7H2,1-3H3
InChIKey UGMLJEWZUROELD-UHFFFAOYSA-N
Molecular Weight 236.267 g/mol
SMILES C12(C(OC(C=C2)=O)CC(=C(C1)C)C)C(=O)OC
SPLASH splash10-001i-9210000000-89773b38819235045ea0
Source of Spectrum F-34-1899-0
Synonyms 2-Oxa-5-methoxy carbonyl-8,9-dimethyl bicyclo(4.4.0)decan-4,8-diene-3-one Methyl 6,7-dimethyl-2-oxo-8,8a-dihydro-2H-chromene-4a(5H)-carboxylate
Wiley ID 1238041