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2-(1'-GERANOYLOXY)-4,6,BETA-TRIHYDROXYACETOPHENONE
SpectraBase Compound ID 3hwEtL7zkVb
InChI InChI=1S/C18H24O5/c1-12(2)5-4-6-13(3)7-8-23-17-10-14(20)9-15(21)18(17)16(22)11-19/h5,7,9-10,19-21H,4,6,8,11H2,1-3H3/b13-7+
InChIKey WZBHGSCBQIAXHJ-NTUHNPAUSA-N
Mol Weight 320.38 g/mol
Molecular Formula C18H24O5
Exact Mass 320.162374 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5lBQlZutsQb
Name 2-(1'-Geranyloxy)-4,6,.beta.-trihydroxyacetophenone
Alternate Name(s) 1-[2-[(2E)-3,7-dimethylocta-2,6-dienoxy]-4,6-dihydroxyphenyl]-2-hydroxyethanone 1-[2-[(2E)-3,7-dimethylocta-2,6-dienoxy]-4,6-bis(oxidanyl)phenyl]-2-oxidanyl-ethanone
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H24O5
InChI InChI=1S/C18H24O5/c1-12(2)5-4-6-13(3)7-8-23-17-10-14(20)9-15(21)18(17)16(22)11-19/h5,7,9-10,19-21H,4,6,8,11H2,1-3H3/b13-7+
InChIKey WZBHGSCBQIAXHJ-NTUHNPAUSA-N
Molecular Weight 320.385 g/mol
SMILES Oc1cc(c(C(CO)=O)c(c1)OC\C=C\(CCC=C(C)C)C)O
SPLASH splash10-00e9-0509000000-383758848a390a110fcf
Source of Spectrum X2-56-927-2
Wiley ID 1604941