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4,5-Dimethyl-2-phenyl-1-pyrrolidino-1,4-hexadien-3-one
SpectraBase Compound ID DdCjMxV3dfh
InChI InChI=1S/C18H23NO/c1-14(2)15(3)18(20)17(13-19-11-7-8-12-19)16-9-5-4-6-10-16/h4-6,9-10,13H,7-8,11-12H2,1-3H3
InChIKey YKHZSQCSADGBLI-UHFFFAOYSA-N
Mol Weight 269.39 g/mol
Molecular Formula C18H23NO
Exact Mass 269.177964 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E7vXi6LF0Sv
Name 4,5-Dimethyl-2-phenyl-1-pyrrolidino-1,4-hexadien-3-one
Alternate Name(s) 4,5-Dimethyl-2-phenyl-1-(pyrrolidin-1-yl)hexa-1,4-dien-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H23NO
InChI InChI=1S/C18H23NO/c1-14(2)15(3)18(20)17(13-19-11-7-8-12-19)16-9-5-4-6-10-16/h4-6,9-10,13H,7-8,11-12H2,1-3H3
InChIKey YKHZSQCSADGBLI-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cber.19741070708
Molecular Weight 269.388 g/mol
SMILES C(=C(C(C(=CN1CCCC1)c1ccccc1)=O)C)(C)C
SPLASH splash10-00xr-2790000000-fdd9bf6f4e1bc2ad174a
Source of Spectrum K-107-2230-5b
Wiley ID 1793695