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para-Fluoro valeryl fentanyl
SpectraBase Compound ID SgdHLjsV5W
InChI InChI=1S/C24H31FN2O/c1-2-3-9-24(28)27(22-12-10-21(25)11-13-22)23-15-18-26(19-16-23)17-14-20-7-5-4-6-8-20/h4-8,10-13,23H,2-3,9,14-19H2,1H3
InChIKey LRGKRSJHHVAEAD-UHFFFAOYSA-N
Mol Weight 382.52 g/mol
Molecular Formula C24H31FN2O
Exact Mass 382.242042 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID FYXcIzrSRHo
Name para-Fluoro valeryl fentanyl
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 382.242041788 u
Formula C24H31FN2O
InChI InChI=1S/C24H31FN2O/c1-2-3-9-24(28)27(22-12-10-21(25)11-13-22)23-15-18-26(19-16-23)17-14-20-7-5-4-6-8-20/h4-8,10-13,23H,2-3,9,14-19H2,1H3
InChIKey LRGKRSJHHVAEAD-UHFFFAOYSA-N
Molecular Weight 382.523 g/mol
SMILES C1N(CCC(C1)N(C(=O)CCCC)C=1C=CC(=CC1)F)CCC=1C=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.801019