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5-(2,4-dinitroanilino)-6-methyl-6-hepten-2-one
SpectraBase Compound ID ARTX4iuG4YR
InChI InChI=1S/C14H17N3O5/c1-9(2)12(6-4-10(3)18)15-13-7-5-11(16(19)20)8-14(13)17(21)22/h5,7-8,12,15H,1,4,6H2,2-3H3
InChIKey PUXXDHJEEYEJQK-UHFFFAOYSA-N
Mol Weight 307.31 g/mol
Molecular Formula C14H17N3O5
Exact Mass 307.116821 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1I6beaEZMG
Name 5-(2,4-dinitroanilino)-6-methyl-6-hepten-2-one
Alternate Name(s) 5-(2,4-dinitroanilino)-6-methyl-hept-6-en-2-one 5-[(2,4-dinitrophenyl)amino]-6-methyl-hept-6-en-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17N3O5
InChI InChI=1S/C14H17N3O5/c1-9(2)12(6-4-10(3)18)15-13-7-5-11(16(19)20)8-14(13)17(21)22/h5,7-8,12,15H,1,4,6H2,2-3H3
InChIKey PUXXDHJEEYEJQK-UHFFFAOYSA-N
Molecular Weight 307.306 g/mol
SMILES N(c1c(N(=O)=O)cc(N(=O)=O)cc1)C(C(=C)C)CCC(=O)C
SPLASH splash10-014r-2980000000-ab9fe4eae818a45394e2
Source of Spectrum SK-31-3093-2
Wiley ID 882255