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1-(3-Methoxy-2-nitrophenyl)-1,3-hexanedione
SpectraBase Compound ID 5VyPvxR9Ngw
InChI InChI=1S/C13H15NO5/c1-3-5-9(15)8-11(16)10-6-4-7-12(19-2)13(10)14(17)18/h4,6-7H,3,5,8H2,1-2H3
InChIKey MRCQHMRITGPTTO-UHFFFAOYSA-N
Mol Weight 265.26 g/mol
Molecular Formula C13H15NO5
Exact Mass 265.095023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JUtqsUrnMod
Name 1-(3-Methoxy-2-nitrophenyl)-1,3-hexanedione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15NO5
InChI InChI=1S/C13H15NO5/c1-3-5-9(15)8-11(16)10-6-4-7-12(19-2)13(10)14(17)18/h4,6-7H,3,5,8H2,1-2H3
InChIKey MRCQHMRITGPTTO-UHFFFAOYSA-N
Molecular Weight 265.265 g/mol
SMILES C(CC(CCC)=O)(=O)c1c(c(ccc1)OC)N(=O)=O
SPLASH splash10-014i-0930000000-5a694ed89a3821ad16ab
Source of Spectrum OV-1-192-11
Synonyms 1-(3-Methoxy-2-nitrophenyl)hexane-1,3-dione
Wiley ID 1547559