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2-Nitro-3-(2-methoxy-4-methylphenyl)-8-methoxy-1,4-naphthoquinone
SpectraBase Compound ID 42IXipTRRY5
InChI InChI=1S/C19H15NO6/c1-10-7-8-11(14(9-10)26-3)16-17(20(23)24)19(22)15-12(18(16)21)5-4-6-13(15)25-2/h4-9H,1-3H3
InChIKey XTZJEZCREOEHHF-UHFFFAOYSA-N
Mol Weight 353.33 g/mol
Molecular Formula C19H15NO6
Exact Mass 353.089937 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2Dlezwi8eG
Name 2-Nitro-3-(2-methoxy-4-methylphenyl)-8-methoxy-1,4-naphthoquinone
CAS Registry Number 139976-05-9
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H15NO6
InChI InChI=1S/C19H15NO6/c1-10-7-8-11(14(9-10)26-3)16-17(20(23)24)19(22)15-12(18(16)21)5-4-6-13(15)25-2/h4-9H,1-3H3
InChIKey XTZJEZCREOEHHF-UHFFFAOYSA-N
Molecular Weight 353.330 g/mol
SMILES C1(=C(C(=O)c2c(C1=O)c(OC)ccc2)c1c(cc(cc1)C)OC)N(=O)=O
SPLASH splash10-0zfr-0009000000-8a24b319b4cfa15c1d4f
Source of Spectrum J-57-2779-20
Synonyms 5-methoxy-2-(2-methoxy-4-methylphenyl)-3-nitronaphthoquinone
Wiley ID 1343906