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4-Cyclohexyl-4-(dibenzylamino)-1-(2-furyl)but-2-yn-1-one
SpectraBase Compound ID K4oNCMxbmIS
InChI InChI=1S/C28H29NO2/c30-27(28-17-10-20-31-28)19-18-26(25-15-8-3-9-16-25)29(21-23-11-4-1-5-12-23)22-24-13-6-2-7-14-24/h1-2,4-7,10-14,17,20,25-26H,3,8-9,15-16,21-22H2
InChIKey MIPGKLJKJDTIKU-UHFFFAOYSA-N
Mol Weight 411.55 g/mol
Molecular Formula C28H29NO2
Exact Mass 411.219829 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GiZlnGTUa4v
Name 4-Cyclohexyl-4-(dibenzylamino)-1-(2-furyl)but-2-yn-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H29NO2
InChI InChI=1S/C28H29NO2/c30-27(28-17-10-20-31-28)19-18-26(25-15-8-3-9-16-25)29(21-23-11-4-1-5-12-23)22-24-13-6-2-7-14-24/h1-2,4-7,10-14,17,20,25-26H,3,8-9,15-16,21-22H2
InChIKey MIPGKLJKJDTIKU-UHFFFAOYSA-N
Molecular Weight 411.545 g/mol
SMILES C(C#CC(N(Cc1ccccc1)Cc1ccccc1)C1CCCCC1)(=O)c1occc1
SPLASH splash10-004i-1009000000-c3d421f504994d367ee8
Source of Spectrum C5-2004-2020-9
Synonyms 4-cyclohexyl-4-(dibenzylamino)-1-(2-furyl)-2-butyn-1-one
Wiley ID 1617195