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2-[2'-Acetyl-3'-oxocyclohex-1'-yl]-1,4-naphthoquinone
SpectraBase Compound ID 4loyKAL5VvA
InChI InChI=1S/C18H16O4/c1-10(19)17-12(7-4-8-15(17)20)14-9-16(21)11-5-2-3-6-13(11)18(14)22/h2-3,5-6,9,12,17H,4,7-8H2,1H3
InChIKey HKDVYSIBIKVUNS-UHFFFAOYSA-N
Mol Weight 296.32 g/mol
Molecular Formula C18H16O4
Exact Mass 296.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3k2XLx9MyO
Name 2-[2'-Acetyl-3'-oxocyclohex-1'-yl]-1,4-naphthoquinone
Alternate Name(s) 2-(2-acetyl-3-oxocyclohexyl)naphthoquinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16O4
InChI InChI=1S/C18H16O4/c1-10(19)17-12(7-4-8-15(17)20)14-9-16(21)11-5-2-3-6-13(11)18(14)22/h2-3,5-6,9,12,17H,4,7-8H2,1H3
InChIKey HKDVYSIBIKVUNS-UHFFFAOYSA-N
Molecular Weight 296.322 g/mol
SMILES C=1(C(c2ccccc2C(C1)=O)=O)C1C(C(=O)CCC1)C(=O)C
SPLASH splash10-00or-8390000000-4fbae0e7c4f9a4b2adf4
Source of Spectrum K1-2000-1980-8
Wiley ID 750437