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1-PHENYL-3,4,5,6-TETRAHYDRO-1H-2,5-BENZOXACINE-5-CARBOXAMIDINE-HYDROCHLORIDE
SpectraBase Compound ID 4jPlc4Fffj
InChI InChI=1S/C17H19N3O.ClH/c18-17(19)20-10-11-21-16(13-6-2-1-3-7-13)15-9-5-4-8-14(15)12-20;/h1-9,16H,10-12H2,(H3,18,19);1H
InChIKey JQBFDEWXTOQHIB-UHFFFAOYSA-N
Mol Weight 317.82 g/mol
Molecular Formula C17H20ClN3O
Exact Mass 317.12949 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DsGhGw4WEZw
Name 1-PHENYL-3,4,5,6-TETRAHYDRO-1H-2,5-BENZOXACINE-5-CARBOXAMIDINE-HYDROCHLORIDE
Compound Number 4AHCl
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H20ClN3O
InChI InChI=1S/C17H19N3O.ClH/c18-17(19)20-10-11-21-16(13-6-2-1-3-7-13)15-9-5-4-8-14(15)12-20;/h1-9,16H,10-12H2,(H3,18,19);1H
InChIKey JQBFDEWXTOQHIB-UHFFFAOYSA-N
Literature Reference Author A.E.ROSAMILIA,P.A.MAYES,R.PAPADOPOULOS,E.M.CAMPI,W.R.JACKSON ,L.RASH,B.JARROTT
Literature Reference Citation AUSTR.J.CHEM.,55,577(2002)
Literature Reference DOI 10.1071/CH02097
Molecular Weight 317.818 g/mol
Solvent CD3OD
Source File Reference UWKP3337