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4-Ethyl-N-(3-iodophenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]benzamide
SpectraBase Compound ID K6956Zk47IM
InChI InChI=1S/C28H31IN2O/c1-2-22-11-13-24(14-12-22)28(32)31(27-10-6-9-25(29)21-27)26-16-19-30(20-17-26)18-15-23-7-4-3-5-8-23/h3-14,21,26H,2,15-20H2,1H3
InChIKey NYAAUXAVSQHPPZ-UHFFFAOYSA-N
Mol Weight 538.47 g/mol
Molecular Formula C28H31IN2O
Exact Mass 538.148109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JHD61z0GbHk
Name 4-Ethyl-N-(3-iodophenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]benzamide
Classification Fentanyl opioid
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 538.148108625 u
Formula C28H31IN2O
InChI InChI=1S/C28H31IN2O/c1-2-22-11-13-24(14-12-22)28(32)31(27-10-6-9-25(29)21-27)26-16-19-30(20-17-26)18-15-23-7-4-3-5-8-23/h3-14,21,26H,2,15-20H2,1H3
InChIKey NYAAUXAVSQHPPZ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 538.473 g/mol
Nominal Mass 538 u
Quality 1000
Retention Index 3829
SMILES C(N(C1CCN(CC1)CCC=1C=CC=CC1)C=1C=C(C=CC1)I)(C1=CC=C(C=C1)CC)=O
SPLASH splash10-001i-4900000000-5a384b7749973bda6137
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Fentanyl(-propionyl+(4-ethylbenzoyl)-phenyl+(3-iodophenyl))
Technique GC/MS
Wiley ID DD2024_033941