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[DICHLORO-((4S,7R)-7,8,8-TRIMETHYL-1-[(5-METHYLISOXAZOL-3-YL)-METHYL]-4,5,6,7-TETRAHYDRO-4,7-METHANO-1-H-INDAZOLYL)-PALLADAT-(II)]

View entire compound with spectra: 1 NMR

[DICHLORO-((4S,7R)-7,8,8-TRIMETHYL-1-[(5-METHYLISOXAZOL-3-YL)-METHYL]-4,5,6,7-TETRAHYDRO-4,7-METHANO-1-H-INDAZOLYL)-PALLADAT-(II)]
SpectraBase Compound ID 3utXIJo3uQi
InChI InChI=1S/C16H21N3O.2ClH.Pd/c1-10-7-11(18-20-10)9-19-14-12(8-17-19)13-5-6-16(14,4)15(13,2)3;;;/h7-8,13H,5-6,9H2,1-4H3;2*1H;/q;;;+2/p-2/t13-,16+;;;/m0.../s1
InChIKey ZAGDQORKJGPJFT-DUHMYJLJSA-L
Mol Weight 448.69 g/mol
Molecular Formula C16H21Cl2N3OPd
Exact Mass 447.009648 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1hJ1qq4LY8z
Name [DICHLORO-((4S,7R)-7,8,8-TRIMETHYL-1-[(5-METHYLISOXAZOL-3-YL)-METHYL]-4,5,6,7-TETRAHYDRO-4,7-METHANO-1-H-INDAZOLYL)-PALLADAT-(II)]
Compound Number 23
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H21Cl2N3OPd
InChI InChI=1S/C16H21N3O.2ClH.Pd/c1-10-7-11(18-20-10)9-19-14-12(8-17-19)13-5-6-16(14,4)15(13,2)3;;;/h7-8,13H,5-6,9H2,1-4H3;2*1H;/q;;;+2/p-2/t13-,16+;;;/m0.../s1
InChIKey ZAGDQORKJGPJFT-DUHMYJLJSA-L
Literature Reference Author A.A.WATSON,D.A.HOUSE,P.J.STEEL
Literature Reference Citation AUSTR.J.CHEM.,48,1549(1995)
Literature Reference DOI 10.1071/CH9951549
Molecular Weight 448.688 g/mol
Solvent CDCl3
Source File Reference UWMZ458