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N-4-methylphenyl-N-[1-(1-phenylethyl)piperidin-4-yl]cyclohexanecarboxamide
SpectraBase Compound ID Ew11nEE7IsX
InChI InChI=1S/C27H36N2O/c1-21-13-15-25(16-14-21)29(27(30)24-11-7-4-8-12-24)26-17-19-28(20-18-26)22(2)23-9-5-3-6-10-23/h3,5-6,9-10,13-16,22,24,26H,4,7-8,11-12,17-20H2,1-2H3
InChIKey UOMJQZWSCGTCHU-UHFFFAOYSA-N
Mol Weight 404.6 g/mol
Molecular Formula C27H36N2O
Exact Mass 404.282764 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AMQAHGo9QUH
Name N-4-methylphenyl-N-[1-(1-phenylethyl)piperidin-4-yl]cyclohexanecarboxamide
Classification Fentalogue
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 404.282763786 u
Formula C27H36N2O
InChI InChI=1S/C27H36N2O/c1-21-13-15-25(16-14-21)29(27(30)24-11-7-4-8-12-24)26-17-19-28(20-18-26)22(2)23-9-5-3-6-10-23/h3,5-6,9-10,13-16,22,24,26H,4,7-8,11-12,17-20H2,1-2H3
InChIKey UOMJQZWSCGTCHU-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 404.598 g/mol
Nominal Mass 404 u
Quality 927
Retention Index 3170
SMILES C1(N(C(C2CCCCC2)=O)C=2C=CC(=CC2)C)CCN(C(C=2C=CC=CC2)C)CC1
SPLASH splash10-053r-8910000000-ce823d314ee1afafb9ad
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Fentanyl(-propionyl+cyclohexanecarbonyl-phenyl+(4-methylphenyl)-phenethyl+1-phenylethyl)
Technique GC/MS
Wiley ID DD2024_032919