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para-Chloro cyclopropyl fentanyl

View entire compound with spectra: 1 NMR, 1 FTIR, and 2 MS (GC)

para-Chloro cyclopropyl fentanyl
SpectraBase Compound ID DRUtMPRrPYG
InChI InChI=1S/C23H27ClN2O/c24-20-8-10-21(11-9-20)26(23(27)19-6-7-19)22-13-16-25(17-14-22)15-12-18-4-2-1-3-5-18/h1-5,8-11,19,22H,6-7,12-17H2
InChIKey IPGLBSCVAGTNBX-UHFFFAOYSA-N
Mol Weight 382.94 g/mol
Molecular Formula C23H27ClN2O
Exact Mass 382.181191 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID HK4FXSdTYGU
Name para-Chloro cyclopropyl fentanyl
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 382.181191196 u
Formula C23H27ClN2O
InChI InChI=1S/C23H27ClN2O/c24-20-8-10-21(11-9-20)26(23(27)19-6-7-19)22-13-16-25(17-14-22)15-12-18-4-2-1-3-5-18/h1-5,8-11,19,22H,6-7,12-17H2
InChIKey IPGLBSCVAGTNBX-UHFFFAOYSA-N
Molecular Weight 382.935 g/mol
SMILES C1N(CCC(C1)N(C(=O)C1CC1)C=1C=CC(=CC1)Cl)CCC=1C=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.931086