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Benproperine
SpectraBase Compound ID 6Ne7wxSUDNX
InChI InChI=1S/C21H27NO/c1-18(22-14-8-3-9-15-22)17-23-21-13-7-6-12-20(21)16-19-10-4-2-5-11-19/h2,4-7,10-13,18H,3,8-9,14-17H2,1H3
InChIKey JTUQXGZRVLWBCR-UHFFFAOYSA-N
Mol Weight 309.45 g/mol
Molecular Formula C21H27NO
Exact Mass 309.209264 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JFCtAmXURpQ
Name Benproperine
CAS Registry Number 2156-27-6
Classification Pharmaceutical drug, antitussive
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 309.209264492 u
Formula C21H27NO
InChI InChI=1S/C21H27NO/c1-18(22-14-8-3-9-15-22)17-23-21-13-7-6-12-20(21)16-19-10-4-2-5-11-19/h2,4-7,10-13,18H,3,8-9,14-17H2,1H3
InChIKey JTUQXGZRVLWBCR-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 309.453 g/mol
Nominal Mass 309 u
Quality 963
Retention Index 2396
SMILES C1(=C(OCC(N2CCCCC2)C)C=CC=C1)CC=1C=CC=CC1
SPLASH splash10-03di-4900000000-0badd139c908fea90f0f
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Benproperina 2-Piperidino-1-(2-benzylphenoxy)propane (R,S)-1-[1-(2-Benzylphenoxy)-2-propyl]piperidin
Technique GC/MS
Wiley ID DD2024_026625