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4-(Dibenzylamino)-5-ethyl-1-phenylhept-2-yn-1-one
SpectraBase Compound ID AtKmp2nNbSw
InChI InChI=1S/C29H31NO/c1-3-26(4-2)28(20-21-29(31)27-18-12-7-13-19-27)30(22-24-14-8-5-9-15-24)23-25-16-10-6-11-17-25/h5-19,26,28H,3-4,22-23H2,1-2H3
InChIKey MKLCQQCRVUVZOU-UHFFFAOYSA-N
Mol Weight 409.57 g/mol
Molecular Formula C29H31NO
Exact Mass 409.240565 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4DDPLUsdc0W
Name 4-(Dibenzylamino)-5-ethyl-1-phenylhept-2-yn-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H31NO
InChI InChI=1S/C29H31NO/c1-3-26(4-2)28(20-21-29(31)27-18-12-7-13-19-27)30(22-24-14-8-5-9-15-24)23-25-16-10-6-11-17-25/h5-19,26,28H,3-4,22-23H2,1-2H3
InChIKey MKLCQQCRVUVZOU-UHFFFAOYSA-N
Molecular Weight 409.573 g/mol
SMILES C(C#CC(C(CC)CC)N(Cc1ccccc1)Cc1ccccc1)(=O)c1ccccc1
SPLASH splash10-000l-8109000000-d013278e41d0747b46ae
Source of Spectrum C5-2004-2020-9
Synonyms 4-(dibenzylamino)-5-ethyl-1-phenyl-2-heptyn-1-one
Wiley ID 1617196