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1-(8-Methoxycarbonyl-octyl)-5-normonyl-1H-tetrazole

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1-(8-Methoxycarbonyl-octyl)-5-normonyl-1H-tetrazole
SpectraBase Compound ID 2pPPPmi3T7P
InChI InChI=1S/C27H46N4O7/c1-17(14-23-28-29-30-31(23)12-10-8-6-5-7-9-11-24(33)36-4)13-21-26(35)25(34)20(16-37-21)15-22-27(38-22)18(2)19(3)32/h14,18-22,25-27,32,34-35H,5-13,15-16H2,1-4H3/b17-14+
InChIKey ZITWFUDVNKHUHH-SAPNQHFASA-N
Mol Weight 538.7 g/mol
Molecular Formula C27H46N4O7
Exact Mass 538.33665 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7TbWBuNCNTg
Name 1-(8-Methoxycarbonyl-octyl)-5-normonyl-1H-tetrazole
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C27H46N4O7
InChI InChI=1S/C27H46N4O7/c1-17(14-23-28-29-30-31(23)12-10-8-6-5-7-9-11-24(33)36-4)13-21-26(35)25(34)20(16-37-21)15-22-27(38-22)18(2)19(3)32/h14,18-22,25-27,32,34-35H,5-13,15-16H2,1-4H3/b17-14+
InChIKey ZITWFUDVNKHUHH-SAPNQHFASA-N
Instrument Name Bruker WM-250
Literature Reference M.J. Crimmin, P.J. O'Hanlon, N.H.Rogers, J. Chem. Soc. Perkin I 2047 (1989).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3