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2-{4-[(4,6-DICHLORO-1,3,5-TRIAZIN-2-YL)-AMINO]-BENZYL}-3A,4,7,7A-TETRAHYDRO-4,7-METHANO-1H-ISOINDOLE-1,3(2H)-DIONE
SpectraBase Compound ID CR0YBN87xhy
InChI InChI=1S/C19H15Cl2N5O2/c20-17-23-18(21)25-19(24-17)22-12-5-1-9(2-6-12)8-26-15(27)13-10-3-4-11(7-10)14(13)16(26)28/h1-6,10-11,13-14H,7-8H2,(H,22,23,24,25)/t10-,11+,13-,14+
InChIKey PEELCKXOJUCGDN-WVKUQDAKSA-N
Mol Weight 416.27 g/mol
Molecular Formula C19H15Cl2N5O2
Exact Mass 415.06028 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4TCwby7lA2r
Name 2-{4-[(4,6-DICHLORO-1,3,5-TRIAZIN-2-YL)-AMINO]-BENZYL}-3A,4,7,7A-TETRAHYDRO-4,7-METHANO-1H-ISOINDOLE-1,3(2H)-DIONE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H15Cl2N5O2
InChI InChI=1S/C19H15Cl2N5O2/c20-17-23-18(21)25-19(24-17)22-12-5-1-9(2-6-12)8-26-15(27)13-10-3-4-11(7-10)14(13)16(26)28/h1-6,10-11,13-14H,7-8H2,(H,22,23,24,25)/t10-,11+,13-,14+
InChIKey PEELCKXOJUCGDN-WVKUQDAKSA-N
Literature Reference Author C.A.LARSEN,E.L.TAYLOR,J.N.LAMBERT,J.A.CHIEFARI
Literature Reference Citation AUSTR.J.CHEM.,55,245(2002)
Literature Reference DOI 10.1071/CH02067
Molecular Weight 416.266 g/mol
Solvent CDCl3
Source File Reference UWKP3328