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2,5-Cyclohexadiene-1,4-dione, 5-(2-methoxy-5-methylphenyl)-2,3-dimethyl-
SpectraBase Compound ID LexyE2OakfL
InChI InChI=1S/C16H16O3/c1-9-5-6-15(19-4)12(7-9)13-8-14(17)10(2)11(3)16(13)18/h5-8H,1-4H3
InChIKey ZTPHDBPLQVBPSP-UHFFFAOYSA-N
Mol Weight 256.3 g/mol
Molecular Formula C16H16O3
Exact Mass 256.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JxuCjcEPQZ8
Name 2,5-Cyclohexadiene-1,4-dione, 5-(2-methoxy-5-methylphenyl)-2,3-dimethyl-
CAS Registry Number 83626-53-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16O3
InChI InChI=1S/C16H16O3/c1-9-5-6-15(19-4)12(7-9)13-8-14(17)10(2)11(3)16(13)18/h5-8H,1-4H3
InChIKey ZTPHDBPLQVBPSP-UHFFFAOYSA-N
Molecular Weight 256.301 g/mol
SMILES C=1(C(C(C)=C(C(C1)=O)C)=O)c1c(ccc(c1)C)OC
SPLASH splash10-056u-0090000000-3552fdfbdee133f42eab
Source of Spectrum B-35-1507-0
Synonyms 2-(2'-Methoxy-5'-methylphenyl)-5,6-dimethyl-1,4-benzoquinone 5-(2-Methoxy-5-methylphenyl)-2,3-dimethylbenzo-1,4-quinone
Wiley ID 1260039