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N-(3-Methylphenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]-4-methylbenzamide
SpectraBase Compound ID JpGKwzIAGXD
InChI InChI=1S/C28H32N2O/c1-22-11-13-25(14-12-22)28(31)30(27-10-6-7-23(2)21-27)26-16-19-29(20-17-26)18-15-24-8-4-3-5-9-24/h3-14,21,26H,15-20H2,1-2H3
InChIKey UMDGFVNSBAWTAL-UHFFFAOYSA-N
Mol Weight 412.6 g/mol
Molecular Formula C28H32N2O
Exact Mass 412.251464 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2mkFAeeDe9Q
Name N-(3-Methylphenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]-4-methylbenzamide
Classification Fentanyl opioid
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 412.251463657 u
Formula C28H32N2O
InChI InChI=1S/C28H32N2O/c1-22-11-13-25(14-12-22)28(31)30(27-10-6-7-23(2)21-27)26-16-19-29(20-17-26)18-15-24-8-4-3-5-9-24/h3-14,21,26H,15-20H2,1-2H3
InChIKey UMDGFVNSBAWTAL-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 412.577 g/mol
Nominal Mass 412 u
Quality 998
Retention Index 3257
SMILES C(N(C1=CC(=CC=C1)C)C1CCN(CC1)CCC=1C=CC=CC1)(C1=CC=C(C=C1)C)=O
SPLASH splash10-01b9-1913000000-79625f2e593285647259
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Fentanyl(-propionyl+(4-methylbenzoyl)-phenyl+(3-methylphenyl)) 4-Methyl-N-(3-methylphenyl)-N-(1-(2-phenylethyl)piperidin-4-yl)benzamide
Technique GC/MS
Wiley ID DD2024_025327