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2-(N-Isopropylamino)-7-nitro-6-phenylhept-3-en-4-one
SpectraBase Compound ID 8jf7zGhbQXK
InChI InChI=1S/C16H22N2O3/c1-12(2)17-13(3)9-16(19)10-15(11-18(20)21)14-7-5-4-6-8-14/h4-9,12,15,17H,10-11H2,1-3H3/b13-9-
InChIKey XLSAPTWNHIRXQS-LCYFTJDESA-N
Mol Weight 290.36 g/mol
Molecular Formula C16H22N2O3
Exact Mass 290.163043 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2xqBgGpZBUW
Name 2-(N-Isopropylamino)-7-nitro-6-phenylhept-3-en-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22N2O3
InChI InChI=1S/C16H22N2O3/c1-12(2)17-13(3)9-16(19)10-15(11-18(20)21)14-7-5-4-6-8-14/h4-9,12,15,17H,10-11H2,1-3H3/b13-9-
InChIKey XLSAPTWNHIRXQS-LCYFTJDESA-N
Molecular Weight 290.363 g/mol
SMILES N(\C(=C/C(CC(CN(=O)=O)c1ccccc1)=O)C)C(C)C
SPLASH splash10-03gl-5900000000-57f6216cc7ff8957f6ea
Source of Spectrum F-50-9835-10
Synonyms (Z)-2-Isopropylamino-7-nitro-6-phenyl-hept-2-en-4-one 2-(N-Isopropylamino)-7-nitro-6-phenylhept-2-en-4-one
Wiley ID 1293630