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2-(3-PYRIDIN-3-YLTHIOUREIDO)-3-(PYRROLIDIN-1-YL)-PROPANOIC-ACID

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2-(3-PYRIDIN-3-YLTHIOUREIDO)-3-(PYRROLIDIN-1-YL)-PROPANOIC-ACID
SpectraBase Compound ID BB2Jdhhn1ob
InChI InChI=1S/C13H18N4O2S/c18-12(19)11(9-17-6-1-2-7-17)16-13(20)15-10-4-3-5-14-8-10/h3-5,8,11H,1-2,6-7,9H2,(H,18,19)(H2,15,16,20)
InChIKey BYFRPWFBZDQKBZ-UHFFFAOYSA-N
Mol Weight 294.37 g/mol
Molecular Formula C13H18N4O2S
Exact Mass 294.115047 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JP0t1qTcVyq
Name 2-(3-PYRIDIN-3-YLTHIOUREIDO)-3-(PYRROLIDIN-1-YL)-PROPANOIC-ACID
Compound Number 2K
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H18N4O2S
InChI InChI=1S/C13H18N4O2S/c18-12(19)11(9-17-6-1-2-7-17)16-13(20)15-10-4-3-5-14-8-10/h3-5,8,11H,1-2,6-7,9H2,(H,18,19)(H2,15,16,20)
InChIKey BYFRPWFBZDQKBZ-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 294.372 g/mol
Sample ID 3231
Solvent DMSO-D6