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3-tert-Butyl-5-phenyl-1,2-benzoquinone
SpectraBase Compound ID 3Xze9WC2zE3
InChI InChI=1S/C16H16O2/c1-16(2,3)13-9-12(10-14(17)15(13)18)11-7-5-4-6-8-11/h4-10H,1-3H3
InChIKey XPXFLBLMSOTEIK-UHFFFAOYSA-N
Mol Weight 240.3 g/mol
Molecular Formula C16H16O2
Exact Mass 240.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8FRYfuWZyLf
Name 3-tert-Butyl-5-phenyl-1,2-benzoquinone
CAS Registry Number 24456-99-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16O2
InChI InChI=1S/C16H16O2/c1-16(2,3)13-9-12(10-14(17)15(13)18)11-7-5-4-6-8-11/h4-10H,1-3H3
InChIKey XPXFLBLMSOTEIK-UHFFFAOYSA-N
Molecular Weight 240.302 g/mol
SMILES C1(=CC(c2ccccc2)=CC(C1=O)=O)C(C)(C)C
SPLASH splash10-040r-0790000000-d5d4d1d4d44f067b1301
Source of Spectrum B-32-1866-0
Synonyms 3-tert-Butyl-5-phenyl-cyclohexa-3,5-diene-1,2-dione 3-tert-Butyl-5-phenyl-o-benzoquinone 3-tert-Butyl-5-phenylbenzo-1,2-quinone
Wiley ID 1243443