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2,3-Dichloro-5-hydroxy-6-acetoxy-7-methyl-1,4-naphthoquinone
SpectraBase Compound ID IR62oC2eXV2
InChI InChI=1S/C13H8Cl2O5/c1-4-3-6-7(12(19)13(4)20-5(2)16)11(18)9(15)8(14)10(6)17/h3,19H,1-2H3
InChIKey SLUIWGIHGZHOMT-UHFFFAOYSA-N
Mol Weight 315.11 g/mol
Molecular Formula C13H8Cl2O5
Exact Mass 313.974879 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BygKo5CumWg
Name 2,3-Dichloro-5-hydroxy-6-acetoxy-7-methyl-1,4-naphthoquinone
Alternate Name(s) 6,7-Dichloro-1-hydroxy-3-methyl-5,8-dioxo-5,8-dihydro-2-naphthalenyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H8Cl2O5
InChI InChI=1S/C13H8Cl2O5/c1-4-3-6-7(12(19)13(4)20-5(2)16)11(18)9(15)8(14)10(6)17/h3,19H,1-2H3
InChIKey SLUIWGIHGZHOMT-UHFFFAOYSA-N
Molecular Weight 315.108 g/mol
SMILES Oc1c2C(C(=C(C(c2cc(c1OC(=O)C)C)=O)Cl)Cl)=O
SPLASH splash10-00di-2090000000-a9610524a6666fab8f85
Source of Spectrum B-52-835-10
Wiley ID 810854