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N-(3-(4-bromophenyl)-1-(isopropylimino)prop-2-ynyl)-N-isopropylacetamide
SpectraBase Compound ID HxdK5ktzXh6
InChI InChI=1S/C17H21BrN2O/c1-12(2)19-17(20(13(3)4)14(5)21)11-8-15-6-9-16(18)10-7-15/h6-7,9-10,12-13H,1-5H3/b19-17+
InChIKey IUVVQYNKAUDBLS-HTXNQAPBSA-N
Mol Weight 349.27 g/mol
Molecular Formula C17H21BrN2O
Exact Mass 348.083726 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4nW9ZChmnQ
Name N-(3-(4-bromophenyl)-1-(isopropylimino)prop-2-ynyl)-N-isopropylacetamide
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Formula C17H21BrN2O
InChI InChI=1S/C17H21BrN2O/c1-12(2)19-17(20(13(3)4)14(5)21)11-8-15-6-9-16(18)10-7-15/h6-7,9-10,12-13H,1-5H3/b19-17+
InChIKey IUVVQYNKAUDBLS-HTXNQAPBSA-N
Literature Reference DOI 10.1002/adsc.200700333
Molecular Weight 349.272 g/mol
SMILES C(N(\C(=N\C(C)C)C#Cc1ccc(cc1)Br)C(=O)C)(C)C
SPLASH splash10-0a4i-0179000000-419b0cabae7db6815677
Source of Spectrum ASC-350-61/SM3-4g
Synonyms (E)-N-(3-(4-bromophenyl)-1-(isopropylimino)prop-2-yn-1-yl)-N-isopropylacetamide
Wiley ID 1765680