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7-Ethoxy-2,2-dimethyl-5-oxidanyl-3H-chromen-4-one
SpectraBase Compound ID 6NSSIdK9UyH
InChI InChI=1S/C13H16O4/c1-4-16-8-5-9(14)12-10(15)7-13(2,3)17-11(12)6-8/h5-6,14H,4,7H2,1-3H3
InChIKey RXJACHUNDHBOBO-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 8QWAAR9AH1Q
Name 7-Ethoxy-2,2-dimethyl-5-oxidanyl-3H-chromen-4-one
CAS Registry Number 118948-73-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O4
InChI InChI=1S/C13H16O4/c1-4-16-8-5-9(14)12-10(15)7-13(2,3)17-11(12)6-8/h5-6,14H,4,7H2,1-3H3
InChIKey RXJACHUNDHBOBO-UHFFFAOYSA-N
Molecular Weight 236.267 g/mol
SMILES Oc1c2C(CC(Oc2cc(c1)OCC)(C)C)=O
SPLASH splash10-00di-0490000000-a29f9d81b93da2f225f8
Source of Spectrum Y-25-873-5
Synonyms 7-Ethoxy-5-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-one 7-Ethoxy-5-hydroxy-2,2-dimethyl-3H-chromen-4-one 7-Ethoxy-5-hydroxy-2,2-dimethyl-chroman-4-one
Wiley ID 1238093