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Hexanoylfentanyl hydrochloride

View entire compound with spectra: 1 Raman

Hexanoylfentanyl hydrochloride
SpectraBase Compound ID BSYgDbVCPic
InChI InChI=1S/C25H34N2O.ClH/c1-2-3-6-15-25(28)27(23-13-9-5-10-14-23)24-17-20-26(21-18-24)19-16-22-11-7-4-8-12-22;/h4-5,7-14,24H,2-3,6,15-21H2,1H3;1H
InChIKey HFEFWZZGDYLNIG-UHFFFAOYSA-N
Mol Weight 415.02 g/mol
Molecular Formula C25H35ClN2O
Exact Mass 414.243791 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID AGgypLk0VoI
Name Hexanoylfentanyl hydrochloride
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 414.243791454 u
Formula C25H35ClN2O
InChI InChI=1S/C25H34N2O.ClH/c1-2-3-6-15-25(28)27(23-13-9-5-10-14-23)24-17-20-26(21-18-24)19-16-22-11-7-4-8-12-22;/h4-5,7-14,24H,2-3,6,15-21H2,1H3;1H
InChIKey HFEFWZZGDYLNIG-UHFFFAOYSA-N
Molecular Weight 415.021 g/mol
SMILES C=1C(=CC=CC1)CCN1CCC(CC1)N(C=1C=CC=CC1)C(CCCCC)=O.Cl
Spectrum/Structure Validation Score (Raman) 0.980446