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2,5-Cyclohexadiene-1,4-dione, 2-hydroxy-5-methoxy-3-(1-phenylethyl)-

View entire compound with spectra: 1 MS (GC)

2,5-Cyclohexadiene-1,4-dione, 2-hydroxy-5-methoxy-3-(1-phenylethyl)-
SpectraBase Compound ID 6RtTI1FQR8W
InChI InChI=1S/C15H14O4/c1-9(10-6-4-3-5-7-10)13-14(17)11(16)8-12(19-2)15(13)18/h3-9,17H,1-2H3
InChIKey MHEMQAMYAUODCB-UHFFFAOYSA-N
Mol Weight 258.27 g/mol
Molecular Formula C15H14O4
Exact Mass 258.089209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1PgmkwKqpdf
Name 2,5-Cyclohexadiene-1,4-dione, 2-hydroxy-5-methoxy-3-(1-phenylethyl)-
Alternate Name(s) 2-Hydroxy-5-methoxy-3-(1-phenylethyl)benzo-1,4-quinone 3-(1-Phenylethyl)-2-hydroxy-5-methoxy-1,4-benzoquinone
CAS Registry Number 115686-00-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H14O4
InChI InChI=1S/C15H14O4/c1-9(10-6-4-3-5-7-10)13-14(17)11(16)8-12(19-2)15(13)18/h3-9,17H,1-2H3
InChIKey MHEMQAMYAUODCB-UHFFFAOYSA-N
Molecular Weight 258.273 g/mol
SMILES OC1=C(C(C(=CC1=O)OC)=O)C(c1ccccc1)C
SPLASH splash10-0a4i-2090000000-97fd5f0a2f40369f2e0c
Source of Spectrum F-43-4175-1
Wiley ID 1261845