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Pentylone hydrochloride
SpectraBase Compound ID HrJjHkMXPg
InChI InChI=1S/C13H17NO3.ClH/c1-3-4-10(14-2)13(15)9-5-6-11-12(7-9)17-8-16-11;/h5-7,10,14H,3-4,8H2,1-2H3;1H
InChIKey WEFFVTZHXLDTJV-UHFFFAOYSA-N
Mol Weight 271.74 g/mol
Molecular Formula C13H18ClNO3
Exact Mass 271.097521 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 90Ajij9oq99
Name PENTYLONE-HYDROCHLORIDE;2-METHYLAMINO-1-(3,4-METHYLENEDIOXYPHENYL)-PENTAN-1-ONE-HYDROCHLORIDE
Compound Number 2. HCL
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H18ClNO3
InChI InChI=1S/C13H17NO3.ClH/c1-3-4-10(14-2)13(15)9-5-6-11-12(7-9)17-8-16-11;/h5-7,10,14H,3-4,8H2,1-2H3;1H
InChIKey WEFFVTZHXLDTJV-UHFFFAOYSA-N
Literature Reference Author F.WESTPHAL,T.JUNGE,U.GIRRESER,W.GREIBL,C.DOERING
Literature Reference Citation FOR.SCI.INT.,217,157(2012)
Literature Reference DOI 10.1016/j.forsciint.2011.10.045
Molecular Weight 271.744 g/mol
Sample ID 70786
Solvent DMSO-D6