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EVODIONE;6-ACETYL-5,7,8-TRIMETHOXY-2,2-DIMETHYL-2H-1-BENZOPYRAN
SpectraBase Compound ID 4SeRJ39MAY9
InChI InChI=1S/C16H20O5/c1-9(17)11-12(18-4)10-7-8-16(2,3)21-13(10)15(20-6)14(11)19-5/h7-8H,1-6H3
InChIKey NIRIGVIWLIYHJU-UHFFFAOYSA-N
Mol Weight 292.33 g/mol
Molecular Formula C16H20O5
Exact Mass 292.131074 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7ZEKhw0MCQh
Name Evodione
CAS Registry Number 482-07-5
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 292.131073739 u
Formula C16H20O5
InChI InChI=1S/C16H20O5/c1-9(17)11-12(18-4)10-7-8-16(2,3)21-13(10)15(20-6)14(11)19-5/h7-8H,1-6H3
InChIKey NIRIGVIWLIYHJU-UHFFFAOYSA-N
Molecular Weight 292.331 g/mol
Number of Peaks 50
RI1 1907
SMILES CC(c1c(c2C=CC(C)(C)Oc2c(c1OC)OC)OC)=O
SPLASH splash10-004i-2190000000-be9e31ef8a6c15d5735a
Sample Comments RI1: measured on SLB-5ms (Hydro) RI2: measured on SLB-5ms (FAMEs) RI3: measured on Supelcowax-10 (FAMEs) RI4: measured on Supelcowax-10 (FAEEs) RI5: measured on Equity-1 (Hydro)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms Ethanone, 1-(5,7,8-trimethoxy-2,2-dimethyl-2H-1-benzopyran-6-yl)-
Wiley ID LM_FFNSC3_2962