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3-(hexylamino)-1-phenyl-but-2-en-1-one
SpectraBase Compound ID 3tHCbuCPe8u
InChI InChI=1S/C16H23NO/c1-3-4-5-9-12-17-14(2)13-16(18)15-10-7-6-8-11-15/h6-8,10-11,13,17H,3-5,9,12H2,1-2H3
InChIKey HSRRZZYQNFPOKC-UHFFFAOYSA-N
Mol Weight 245.37 g/mol
Molecular Formula C16H23NO
Exact Mass 245.177964 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Chy5GjbkPQx
Name 3-(hexylamino)-1-phenyl-but-2-en-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H23NO
InChI InChI=1S/C16H23NO/c1-3-4-5-9-12-17-14(2)13-16(18)15-10-7-6-8-11-15/h6-8,10-11,13,17H,3-5,9,12H2,1-2H3
InChIKey HSRRZZYQNFPOKC-UHFFFAOYSA-N
Instrument Name Shimadzu GC-2014 or Shimadzu GC-MS QP 2010
Ionization Type EI
Literature Reference DOI 10.1002/ajoc.202200473
Molecular Weight 245.366 g/mol
SMILES N(C(=CC(c1ccccc1)=O)C)CCCCCC
SPLASH splash10-05bf-4900000000-694978955e8adcd5e779
Source of Spectrum AJO-11-SM19-4h-i
Wiley ID 1880168