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3-(cyclohexylamino)-1-phenylbut-2-en-1-one
SpectraBase Compound ID 3n0PFsvvpJF
InChI InChI=1S/C16H21NO/c1-13(17-15-10-6-3-7-11-15)12-16(18)14-8-4-2-5-9-14/h2,4-5,8-9,12,15,17H,3,6-7,10-11H2,1H3
InChIKey TWGVGLICEJDAJL-UHFFFAOYSA-N
Mol Weight 243.35 g/mol
Molecular Formula C16H21NO
Exact Mass 243.162314 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LeUQQkanJrq
Name 3-(cyclohexylamino)-1-phenylbut-2-en-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H21NO
InChI InChI=1S/C16H21NO/c1-13(17-15-10-6-3-7-11-15)12-16(18)14-8-4-2-5-9-14/h2,4-5,8-9,12,15,17H,3,6-7,10-11H2,1H3
InChIKey TWGVGLICEJDAJL-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 243.350 g/mol
SMILES N(C1CCCCC1)C(=CC(=O)c1ccccc1)C
SPLASH splash10-0a4l-5920000000-fb8ada998f6cab75d9da
Source of Spectrum AJO-11-SM18-4c-d
Wiley ID 1880166