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3,6-Dibromo-5,8-dihydroxy-2-methyl-1,4-naphthalenedione
SpectraBase Compound ID 8lvirGxQ5Az
InChI InChI=1S/C11H6Br2O4/c1-3-8(13)11(17)7-6(9(3)15)5(14)2-4(12)10(7)16/h2,14,16H,1H3
InChIKey XWTCJGNNRHVYLD-UHFFFAOYSA-N
Mol Weight 361.97 g/mol
Molecular Formula C11H6Br2O4
Exact Mass 359.863285 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6EJ71vUjBf5
Name 3,6-Dibromo-5,8-dihydroxy-2-methyl-1,4-naphthalenedione
CAS Registry Number 104506-35-6
Comments Structure changed after expert review
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H6Br2O4
InChI InChI=1S/C11H6Br2O4/c1-3-8(13)11(17)7-6(9(3)15)5(14)2-4(12)10(7)16/h2,14,16H,1H3
InChIKey XWTCJGNNRHVYLD-UHFFFAOYSA-N
Molecular Weight 361.973 g/mol
SMILES Oc1c(cc(c2C(C(=C(C(c12)=O)Br)C)=O)O)Br
SPLASH splash10-03di-8349000000-0097ea9a2ab35a5e9bea
Source of Spectrum W5-1989-34839-30697
Synonyms 3,6-Dibromo-5,8-dihydroxy-2-methylnaphthoquinone
Wiley ID 1347964