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HEXAKIS-(PYRAZOL-1-YL-METHYL)-BENZENE
SpectraBase Compound ID 2gWlIbRZV0F
InChI InChI=1S/C30H30N12/c1-7-31-37(13-1)19-25-26(20-38-14-2-8-32-38)28(22-40-16-4-10-34-40)30(24-42-18-6-12-36-42)29(23-41-17-5-11-35-41)27(25)21-39-15-3-9-33-39/h1-18H,19-24H2
InChIKey JKWQWVDZSGMCFM-UHFFFAOYSA-N
Mol Weight 558.65 g/mol
Molecular Formula C30H30N12
Exact Mass 558.271639 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KQ5KdylaHjK
Name HEXAKIS-(PYRAZOL-1-YL-METHYL)-BENZENE
Compound Number 16
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H30N12
InChI InChI=1S/C30H30N12/c1-7-31-37(13-1)19-25-26(20-38-14-2-8-32-38)28(22-40-16-4-10-34-40)30(24-42-18-6-12-36-42)29(23-41-17-5-11-35-41)27(25)21-39-15-3-9-33-39/h1-18H,19-24H2
InChIKey JKWQWVDZSGMCFM-UHFFFAOYSA-N
Literature Reference Author C.M.HARTSHORN,P.J.STEEL
Literature Reference Citation AUSTR.J.CHEM.,48,1587(1995)
Literature Reference DOI 10.1071/CH9951587
Molecular Weight 558.649 g/mol
Solvent CDCl3
Source File Reference UWMZ334