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5-CYCLOPROPYL-N,N,N',N',2-PENTAMETHYL-3-PHENYL-2,3-DIHYDROISOXAZOLE-4-CARBOXAMIDINIUM-TETRAPHENYLBORATE
SpectraBase Compound ID 9rxoh1u7c7B
InChI InChI=1S/C24H20B.C18H26N3O/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24;1-19(2)18(20(3)4)15-16(13-9-7-6-8-10-13)21(5)22-17(15)14-11-12-14/h1-20H;6-10,14,16H,11-12H2,1-5H3/q-1;+1
InChIKey FQJONSQHIMZIAO-UHFFFAOYSA-N
Mol Weight 619.66 g/mol
Molecular Formula C42H46BN3O
Exact Mass 619.373393 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FdnFUaCwpVf
Name 5-CYCLOPROPYL-N,N,N',N',2-PENTAMETHYL-3-PHENYL-2,3-DIHYDROISOXAZOLE-4-CARBOXAMIDINIUM-TETRAPHENYLBORATE
Compound Number 5B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C42H46BN3O
InChI InChI=1S/C24H20B.C18H26N3O/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24;1-19(2)18(20(3)4)15-16(13-9-7-6-8-10-13)21(5)22-17(15)14-11-12-14/h1-20H;6-10,14,16H,11-12H2,1-5H3/q-1;+1
InChIKey FQJONSQHIMZIAO-UHFFFAOYSA-N
Literature Reference Author W.WEINGAERTNER,G.MAAS
Literature Reference Citation EUR.J.ORG.CHEM.,2012,6372(2012)
Literature Reference DOI 10.1002/ejoc.201201005
Molecular Weight 619.657 g/mol
Solvent CD3CN
Source File Reference UWLU83596