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4,14-Diisopropyl-19-methyl-21-phenylthio-6,9,12-trioxa-3,16,19-triaza-bicyclo(15.3.1)heneicosa-17,20-diene-2,15,13,16-te

View entire compound with spectra: 1 NMR

4,14-Diisopropyl-19-methyl-21-phenylthio-6,9,12-trioxa-3,16,19-triaza-bicyclo(15.3.1)heneicosa-17,20-diene-2,15,13,16-te
SpectraBase Compound ID IhZOfbFdrsW
InChI InChI=1S/C28H37N3O7S/c1-17(2)22-27(34)37-13-11-36-12-14-38-28(35)23(18(3)4)30-26(33)21-16-31(5)15-20(25(32)29-22)24(21)39-19-9-7-6-8-10-19/h6-10,15-18,22-24H,11-14H2,1-5H3,(H,29,32)(H,30,33)
InChIKey SQLCPSKBAYLRFS-UHFFFAOYSA-N
Mol Weight 559.7 g/mol
Molecular Formula C28H37N3O7S
Exact Mass 559.235222 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9uDVDV6bA2p
Name 4,14-Diisopropyl-19-methyl-21-phenylthio-6,9,12-trioxa-3,16,19-triaza-bicyclo(15.3.1)heneicosa-17,20-diene-2,15,13,16-te
Comments (4S,14S)-ISOMER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C28H37N3O7S
InChI InChI=1S/C28H37N3O7S/c1-17(2)22-27(34)37-13-11-36-12-14-38-28(35)23(18(3)4)30-26(33)21-16-31(5)15-20(25(32)29-22)24(21)39-19-9-7-6-8-10-19/h6-10,15-18,22-24H,11-14H2,1-5H3,(H,29,32)(H,30,33)
InChIKey SQLCPSKBAYLRFS-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference B.J. Van Keulen, R.M. Kellogg, J. Am. Chem. Soc. 106, 6029 (1984).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3