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N-(3-Iodophenyl)-3-methyl-N-[1-(2-phenylethyl)piperidin-4-yl]benzamide
SpectraBase Compound ID 2znaV2sQ8Qp
InChI InChI=1S/C27H29IN2O/c1-21-7-5-10-23(19-21)27(31)30(26-12-6-11-24(28)20-26)25-14-17-29(18-15-25)16-13-22-8-3-2-4-9-22/h2-12,19-20,25H,13-18H2,1H3
InChIKey MXHAYXWKHLURDE-UHFFFAOYSA-N
Mol Weight 524.45 g/mol
Molecular Formula C27H29IN2O
Exact Mass 524.132459 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2ktvk8elqHA
Name N-(3-Iodophenyl)-3-methyl-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 524.132458561 u
Formula C27H29IN2O
InChI InChI=1S/C27H29IN2O/c1-21-7-5-10-23(19-21)27(31)30(26-12-6-11-24(28)20-26)25-14-17-29(18-15-25)16-13-22-8-3-2-4-9-22/h2-12,19-20,25H,13-18H2,1H3
InChIKey MXHAYXWKHLURDE-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 524.446 g/mol
Nominal Mass 524 u
Quality 1000
Retention Index 3504
SMILES C=1(N(C(C=2C=C(C=CC2)C)=O)C2CCN(CC2)CCC=2C=CC=CC2)C=C(C=CC1)I
SPLASH splash10-014i-3910200000-0ec8d42a6235bd1a0fc0
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Fentanyl(-propionyl+(3-methylbenzoyl)-phenyl+(3-iodophenyl))
Technique GC/MS
Wiley ID DD2024_033940