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1-(2,4,6-Trihydroxyphenyl)-3-(3-hydroxy-4-methoxy-6-nitrophenyl)propanone
SpectraBase Compound ID 9uBKAmyy4eE
InChI InChI=1S/C16H15NO8/c1-25-15-7-10(17(23)24)8(4-12(15)20)2-3-11(19)16-13(21)5-9(18)6-14(16)22/h4-7,18,20-22H,2-3H2,1H3
InChIKey KXLIFNGPHUTHKM-UHFFFAOYSA-N
Mol Weight 349.3 g/mol
Molecular Formula C16H15NO8
Exact Mass 349.079766 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6wX48g0HS9o
Name 1-(2,4,6-Trihydroxyphenyl)-3-(3-hydroxy-4-methoxy-6-nitrophenyl)propanone
Alternate Name(s) 3-(5-hydroxy-4-methoxy-2-nitrophenyl)-1-(2,4,6-trihydroxyphenyl)-1-propanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H15NO8
InChI InChI=1S/C16H15NO8/c1-25-15-7-10(17(23)24)8(4-12(15)20)2-3-11(19)16-13(21)5-9(18)6-14(16)22/h4-7,18,20-22H,2-3H2,1H3
InChIKey KXLIFNGPHUTHKM-UHFFFAOYSA-N
Molecular Weight 349.295 g/mol
SMILES Oc1c(c(cc(c1)O)O)C(CCc1c(N(=O)=O)cc(OC)c(c1)O)=O
SPLASH splash10-0udi-0900000000-f736d500b0ba1f701802
Source of Spectrum O-26-45-10
Wiley ID 1341269