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1,4-Naphthoquinone, 2-acetyl-5,8-dihydroxy-3,6,7-trimethoxy-
SpectraBase Compound ID CtioVbAyGdp
InChI InChI=1S/C15H14O8/c1-5(16)6-9(17)7-8(10(18)13(6)21-2)12(20)15(23-4)14(22-3)11(7)19/h17-18H,1-4H3
InChIKey PZBCZYCYMKYYSB-UHFFFAOYSA-N
Mol Weight 322.27 g/mol
Molecular Formula C15H14O8
Exact Mass 322.068867 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5MuPK9IMBIy
Name 1,4-Naphthoquinone, 2-acetyl-5,8-dihydroxy-3,6,7-trimethoxy-
CAS Registry Number 14090-56-3
Comments Structure changed after expert review
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H14O8
InChI InChI=1S/C15H14O8/c1-5(16)6-9(17)7-8(10(18)13(6)21-2)12(20)15(23-4)14(22-3)11(7)19/h17-18H,1-4H3
InChIKey PZBCZYCYMKYYSB-UHFFFAOYSA-N
Molecular Weight 322.269 g/mol
SMILES Oc1c2c(c(c(c1C(C)=O)OC)O)C(C(=C(C2=O)OC)OC)=O
SPLASH splash10-05fr-3359000000-3f829de4dd7ab002fb14
Source of Spectrum T-66-1360-0
Synonyms 6-Acetyl-5,8-dihydroxy-2,3,7-trimethoxynaphthoquinone
Wiley ID 1321429