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Plumbagin
SpectraBase Compound ID KQoNxpUWWyC
InChI InChI=1S/C11H8O3/c1-6-5-9(13)10-7(11(6)14)3-2-4-8(10)12/h2-5,12H,1H3
InChIKey VCMMXZQDRFWYSE-UHFFFAOYSA-N
Mol Weight 188.18 g/mol
Molecular Formula C11H8O3
Exact Mass 188.047344 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1dUaXEehzzF
Name 1,4-Naphthalenedione, 5-hydroxy-2-methyl-
Alternate Name(s) 1,4-Naphthoquinone, 5-hydroxy-2-methyl- 2-Methyl-5-hydroxy-1,4-naphthoquinone 2-Methyl-5-oxidanyl-naphthalene-1,4-dione 2-Methyljuglone 5- hydroxy,2-methyl-1,4-naphtoquinone 5-Hydroxy-2-methyl-1,4-naphthalenedione 5-Hydroxy-2-methyl-1,4-naphthoquinone 5-Hydroxy-2-methyl-naphthalene-1,4-dione Plumbaein Plumbagin Plumbagine Plumbagone AI3-38055 BRN 1870475 CCRIS 6671 EINECS 207-569-6 NSC 236613 NSC 688284
CAS Registry Number 481-42-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H8O3
InChI InChI=1S/C11H8O3/c1-6-5-9(13)10-7(11(6)14)3-2-4-8(10)12/h2-5,12H,1H3
InChIKey VCMMXZQDRFWYSE-UHFFFAOYSA-N
Molecular Weight 188.182 g/mol
SMILES Oc1c2c(ccc1)C(C(=CC2=O)C)=O
SPLASH splash10-0079-0900000000-a6933d07f4c8c0ff41c1
Source of Spectrum O-30-1126-0
Wiley ID 1184705