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1-[4-[3-methyl-3-[(phenylmethyl)amino]pent-1-ynyl]phenyl]ethanone
SpectraBase Compound ID 5yYUZBtH6hr
InChI InChI=1S/C21H23NO/c1-4-21(3,22-16-19-8-6-5-7-9-19)15-14-18-10-12-20(13-11-18)17(2)23/h5-13,22H,4,16H2,1-3H3
InChIKey BJHPTURTKYOSTL-UHFFFAOYSA-N
Mol Weight 305.42 g/mol
Molecular Formula C21H23NO
Exact Mass 305.177964 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7Hi0wfgcxGN
Name 1-[4-[3-methyl-3-[(phenylmethyl)amino]pent-1-ynyl]phenyl]ethanone
Alternate Name(s) 1-[4-[3-(benzylamino)-3-methylpent-1-ynyl]phenyl]ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H23NO
InChI InChI=1S/C21H23NO/c1-4-21(3,22-16-19-8-6-5-7-9-19)15-14-18-10-12-20(13-11-18)17(2)23/h5-13,22H,4,16H2,1-3H3
InChIKey BJHPTURTKYOSTL-UHFFFAOYSA-N
Molecular Weight 305.421 g/mol
SMILES N(C(C#Cc1ccc(C(C)=O)cc1)(CC)C)Cc1ccccc1
SPLASH splash10-004i-0092000000-27ae67729923904e6c3f
Source of Spectrum F4-0-2025-2
Wiley ID 1619950