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1,4-Naphthoquinone, 2-acetyl-3,5,8-trihydroxy-6-methoxy-
SpectraBase Compound ID JvTBrWhRHGI
InChI InChI=1S/C13H10O7/c1-4(14)7-11(17)8-5(15)3-6(20-2)10(16)9(8)13(19)12(7)18/h3,17-19H,1-2H3
InChIKey GEOIFUNYZMDHEN-UHFFFAOYSA-N
Mol Weight 278.22 g/mol
Molecular Formula C13H10O7
Exact Mass 278.042653 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ECPfI2UosQG
Name 1,4-Naphthoquinone, 2-acetyl-3,5,8-trihydroxy-6-methoxy-
CAS Registry Number 15254-72-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H10O7
InChI InChI=1S/C13H10O7/c1-4(14)7-11(17)8-5(15)3-6(20-2)10(16)9(8)13(19)12(7)18/h3,17-19H,1-2H3
InChIKey GEOIFUNYZMDHEN-UHFFFAOYSA-N
Molecular Weight 278.216 g/mol
SMILES Oc1c(c(c(c2c1C(C(=CC2=O)OC)=O)O)C(C)=O)O
SPLASH splash10-004u-8490000000-1a3e6bf070e13a6b5b93
Source of Spectrum T-66-1152-0
Synonyms 6-Acetyl-5,7,8-trihydroxy-2-methoxy-1,4-naphthoquinone 6-Acetyl-5,7,8-trihydroxy-2-methoxy-naphthalene-1,4-dione 6-Ethanoyl-2-methoxy-5,7,8-tris(oxidanyl)naphthalene-1,4-dione
Wiley ID 40550