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3-Amino-2,5,8-trihydroxy-6,7-dimethylnaphthalene-1,4-dione

View entire compound with spectra: 1 MS (GC)

3-Amino-2,5,8-trihydroxy-6,7-dimethylnaphthalene-1,4-dione
SpectraBase Compound ID 5aM87pnLVcO
InChI InChI=1S/C12H11NO5/c1-3-4(2)9(15)6-5(8(3)14)10(16)7(13)12(18)11(6)17/h14-15,18H,13H2,1-2H3
InChIKey GXXRSUIPECEDGO-UHFFFAOYSA-N
Mol Weight 249.22 g/mol
Molecular Formula C12H11NO5
Exact Mass 249.063722 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 45i5xRFZZ0s
Name 3-Amino-2,5,8-trihydroxy-6,7-dimethylnaphthalene-1,4-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11NO5
InChI InChI=1S/C12H11NO5/c1-3-4(2)9(15)6-5(8(3)14)10(16)7(13)12(18)11(6)17/h14-15,18H,13H2,1-2H3
InChIKey GXXRSUIPECEDGO-UHFFFAOYSA-N
Molecular Weight 249.222 g/mol
SMILES NC1=C(C(c2c(c(c(c(c2O)C)C)O)C1=O)=O)O
SPLASH splash10-0002-1290000000-9188426f84ac9443d5cb
Source of Spectrum F4-43-3356-7d
Wiley ID 1690502