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6-Acetyl-3-chloro-7-hydroxyjuglone
SpectraBase Compound ID 7z14lzdQqWj
InChI InChI=1S/C12H7ClO5/c1-4(14)9-8(16)2-5-7(15)3-6(13)11(17)10(5)12(9)18/h2-3,16,18H,1H3
InChIKey QMGQVGHZWMEUBQ-UHFFFAOYSA-N
Mol Weight 266.64 g/mol
Molecular Formula C12H7ClO5
Exact Mass 265.998201 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CIGtbiVSwaM
Name 6-Acetyl-3-chloro-7-hydroxyjuglone
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H7ClO5
InChI InChI=1S/C12H7ClO5/c1-4(14)9-8(16)2-5-7(15)3-6(13)11(17)10(5)12(9)18/h2-3,16,18H,1H3
InChIKey QMGQVGHZWMEUBQ-UHFFFAOYSA-N
Molecular Weight 266.636 g/mol
SMILES Oc1c(c(cc2c1C(C(=CC2=O)Cl)=O)O)C(=O)C
SPLASH splash10-0udi-0090000000-dbe6a2ac3d02bee7676b
Source of Spectrum SO-0-706-8
Synonyms 7-acetyl-2-chloro-6,8-dihydroxynaphthalene-1,4-dione 7-acetyl-2-chloro-6,8-dihydroxy-naphthalene-1,4-dione 2-chloranyl-7-ethanoyl-6,8-bis(oxidanyl)naphthalene-1,4-dione
Wiley ID 1544961