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2-HYDROXY-2-(1',3',4',5',6',7'-HEXAHYDRO-1,3-DIAZEPIN-2'-YLIUM-2'-YL)-1-PHENYLIMINOPROPANE-1-THIOLATE
SpectraBase Compound ID 28pdRYhIJqz
InChI InChI=1S/C14H21N3OS/c1-14(18,12-15-9-5-6-10-16-12)13(19)17-11-7-3-2-4-8-11/h2-4,7-8,12,15-16,18H,5-6,9-10H2,1H3,(H,17,19)/p-1
InChIKey GIOFFLJDIFSBPF-UHFFFAOYSA-M
Mol Weight 278.39 g/mol
Molecular Formula C14H20N3OS
Exact Mass 278.132708 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IotJ6CV1tVE
Name 2-HYDROXY-2-(1',3',4',5',6',7'-HEXAHYDRO-1,3-DIAZEPIN-2'-YLIUM-2'-YL)-1-PHENYLIMINOPROPANE-1-THIOLATE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H20N3OS
InChI InChI=1S/C14H21N3OS/c1-14(18,12-15-9-5-6-10-16-12)13(19)17-11-7-3-2-4-8-11/h2-4,7-8,12,15-16,18H,5-6,9-10H2,1H3,(H,17,19)/p-1
InChIKey GIOFFLJDIFSBPF-UHFFFAOYSA-M
Literature Reference Author B.ZALESKA,T.BAZANEK,R.SOCHA,M.KARELUS,J.GROCHOWSKI,P.SERDA
Literature Reference Citation J.ORG.CHEM.,67,4526(2002)
Literature Reference DOI 10.1021/jo025602a
Molecular Weight 278.392 g/mol
Solvent CDCl3
Source File Reference UWVN23277