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2-(3-PHENYLTHIOUREIDO)-3-(PYRROLIDIN-1-YL)-PROPANOIC-ACID-HYDROCHLORIDE
SpectraBase Compound ID 5SEAzLZ1joP
InChI InChI=1S/C15H21N3O2S.ClH/c19-14(20)13(11-18-9-5-2-6-10-18)17-15(21)16-12-7-3-1-4-8-12;/h1,3-4,7-8,13H,2,5-6,9-11H2,(H,19,20)(H2,16,17,21);1H
InChIKey OCEFARRHIHTORW-UHFFFAOYSA-N
Mol Weight 343.87 g/mol
Molecular Formula C15H22ClN3O2S
Exact Mass 343.112126 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2FMRph0hx5z
Name 2-(3-PHENYLTHIOUREIDO)-3-(PYRROLIDIN-1-YL)-PROPANOIC-ACID-HYDROCHLORIDE
Compound Number 2J
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H22ClN3O2S
InChI InChI=1S/C15H21N3O2S.ClH/c19-14(20)13(11-18-9-5-2-6-10-18)17-15(21)16-12-7-3-1-4-8-12;/h1,3-4,7-8,13H,2,5-6,9-11H2,(H,19,20)(H2,16,17,21);1H
InChIKey OCEFARRHIHTORW-UHFFFAOYSA-N
Literature Reference Author F.FUJISAKI,K.SHOJI,K.SUMOTO
Literature Reference Citation CHEM.PHARM.BULL.,57,1415(2009)
Literature Reference DOI 10.1248/cpb.57.1415
Molecular Weight 343.872 g/mol
Sample ID 3230
Solvent DMSO-D6