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Meta-methyl acetyl fentanyl

View entire compound with spectra: 1 NMR, 1 FTIR, and 3 MS (GC)

Meta-methyl acetyl fentanyl
SpectraBase Compound ID F76heyfmZpe
InChI InChI=1S/C22H28N2O/c1-18-7-6-10-22(17-18)24(19(2)25)21-12-15-23(16-13-21)14-11-20-8-4-3-5-9-20/h3-10,17,21H,11-16H2,1-2H3
InChIKey SZZZZTBKJBQTDR-UHFFFAOYSA-N
Mol Weight 336.48 g/mol
Molecular Formula C22H28N2O
Exact Mass 336.220164 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID JXMbJE3tuCU
Name Meta-methyl acetyl fentanyl
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 336.220163529 u
Formula C22H28N2O
InChI InChI=1S/C22H28N2O/c1-18-7-6-10-22(17-18)24(19(2)25)21-12-15-23(16-13-21)14-11-20-8-4-3-5-9-20/h3-10,17,21H,11-16H2,1-2H3
InChIKey SZZZZTBKJBQTDR-UHFFFAOYSA-N
Molecular Weight 336.479 g/mol
SMILES C1N(CCC(C1)N(C(=O)C)C=1C=CC=C(C1)C)CCC=1C=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.899066