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Calix[6]arene

View entire compound with spectra: 2 NMR

Calix[6]arene
SpectraBase Compound ID 1Lez8QIrjCj
InChI InChI=1S/C42H36O6/c43-37-25-7-1-8-26(37)20-28-10-3-12-30(39(28)45)22-32-14-5-16-34(41(32)47)24-36-18-6-17-35(42(36)48)23-33-15-4-13-31(40(33)46)21-29-11-2-9-27(19-25)38(29)44/h1-18,43-48H,19-24H2
InChIKey JLSWUKWFQCVKCL-UHFFFAOYSA-N
Mol Weight 636.7 g/mol
Molecular Formula C42H36O6
Exact Mass 636.251189 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HwJIGDXVhAV
Name Calix[6]arene
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 434108
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C42H36O6
InChI InChI=1S/C42H36O6/c43-37-25-7-1-8-26(37)20-28-10-3-12-30(39(28)45)22-32-14-5-16-34(41(32)47)24-36-18-6-17-35(42(36)48)23-33-15-4-13-31(40(33)46)21-29-11-2-9-27(19-25)38(29)44/h1-18,43-48H,19-24H2
InChIKey JLSWUKWFQCVKCL-UHFFFAOYSA-N
Molecular Weight 636.744 g/mol
Observed nucleus 13C
Purity 98%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_13CNMR_014381