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5,12-Naphthacenedione, 2-acetyl-1,2,3,4-tetrahydro-7-methoxy-, (.+-.)-
SpectraBase Compound ID FQGWkz2dHmk
InChI InChI=1S/C21H18O4/c1-11(22)12-6-7-14-16(8-12)21(24)17-9-13-4-3-5-19(25-2)15(13)10-18(17)20(14)23/h3-5,9-10,12H,6-8H2,1-2H3
InChIKey CNWYXSVOKFUMBY-UHFFFAOYSA-N
Mol Weight 334.37 g/mol
Molecular Formula C21H18O4
Exact Mass 334.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BvCDjJ2rkgo
Name 5,12-Naphthacenedione, 2-acetyl-1,2,3,4-tetrahydro-7-methoxy-, (.+-.)-
CAS Registry Number 86964-04-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H18O4
InChI InChI=1S/C21H18O4/c1-11(22)12-6-7-14-16(8-12)21(24)17-9-13-4-3-5-19(25-2)15(13)10-18(17)20(14)23/h3-5,9-10,12H,6-8H2,1-2H3
InChIKey CNWYXSVOKFUMBY-UHFFFAOYSA-N
Molecular Weight 334.371 g/mol
SMILES C12=C(C(=O)c3c(C2=O)cc2c(c(OC)ccc2)c3)CCC(C1)C(=O)C
SPLASH splash10-000x-0193000000-2b604cc36bd2122fb53f
Source of Spectrum F-40-4558-0
Synonyms (+,-)-2-acetyl-7-methoxy-1,2,3,4-tetrahydro-5,12-naphthacenequinone 2-Acetyl-7-methoxy-1,2,3,4-tetrahydro-5,12-naphthacenedione
Wiley ID 1331180