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ISO-EVODIONOL;6-ACETYL-5-HYDROXY-7-METHOXY-2,2-DIMETHYL-3-CHROMENE;1-(5-HYDROXY-7-METHOXY-2,2-DIMETHYL-2H-CHROMEN-6-YL)-ETHANONE
SpectraBase Compound ID LEzSXn0egia
InChI InChI=1S/C14H16O4/c1-8(15)12-11(17-4)7-10-9(13(12)16)5-6-14(2,3)18-10/h5-7,16H,1-4H3
InChIKey SCSOQELWZNIRDT-UHFFFAOYSA-N
Mol Weight 248.28 g/mol
Molecular Formula C14H16O4
Exact Mass 248.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FwMA4JOobxk
Name 1-(5-Hydroxy-7-methoxy-2,2-dimethyl-2H-chromen-6-yl)ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16O4
InChI InChI=1S/C14H16O4/c1-8(15)12-11(17-4)7-10-9(13(12)16)5-6-14(2,3)18-10/h5-7,16H,1-4H3
InChIKey SCSOQELWZNIRDT-UHFFFAOYSA-N
Instrument Name HP 6890-5973
Ionization Type EI
Literature Reference DOI 10.1021/acs.jnatprod.1c00505
Molecular Weight 248.278 g/mol
SMILES Oc1c2c(cc(c1C(C)=O)OC)OC(C=C2)(C)C
SPLASH splash10-001j-0190000000-f8550aeecb31cfcb07f7
Source of Spectrum G4-84-SM11-11-1
Thin-Layer Chromatography Rf = 0.60 (n-Hexane/ethyl acetate, 3:1)
Wiley ID 1884092