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N-Benzoyl-N-methyl-o-[4-(1-oxo-3-cyclohexyl)butyl]-tyramine
SpectraBase Compound ID DBXPxf0VqwV
InChI InChI=1S/C26H33NO3/c1-27(26(29)23-10-3-2-4-11-23)18-17-21-13-15-25(16-14-21)30-19-6-5-8-22-9-7-12-24(28)20-22/h2-4,10-11,13-16,22H,5-9,12,17-20H2,1H3
InChIKey UECVKHPOIPNPAK-UHFFFAOYSA-N
Mol Weight 407.6 g/mol
Molecular Formula C26H33NO3
Exact Mass 407.246044 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DBuyeM1S1qv
Name N-Benzoyl-N-methyl-o-[4-(1-oxo-3-cyclohexyl)butyl]-tyramine
Alternate Name(s) N-methyl-N-(2-{4-[4-(3-oxocyclohexyl)butoxy]phenyl}ethyl)benzamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H33NO3
InChI InChI=1S/C26H33NO3/c1-27(26(29)23-10-3-2-4-11-23)18-17-21-13-15-25(16-14-21)30-19-6-5-8-22-9-7-12-24(28)20-22/h2-4,10-11,13-16,22H,5-9,12,17-20H2,1H3
InChIKey UECVKHPOIPNPAK-UHFFFAOYSA-N
Molecular Weight 407.554 g/mol
SMILES C(N(CCc1ccc(cc1)OCCCCC1CC(=O)CCC1)C)(=O)c1ccccc1
SPLASH splash10-05fr-0790000000-2e8bda9492a6088d2426
Source of Spectrum J-58-3458-14
Wiley ID 1372650