For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

(8S,9R)-(-)-N-Benzylcinchonidinium chloride

View entire compound with spectra: 2 NMR, and 1 FTIR

(8S,9R)-(-)-N-Benzylcinchonidinium chloride
SpectraBase Compound ID EisnClJAaNl
InChI InChI=1S/C26H29N2O.ClH/c1-2-20-18-28(17-19-8-4-3-5-9-19)15-13-21(20)16-25(28)26(29)23-12-14-27-24-11-7-6-10-22(23)24;/h2-12,14,20-21,25-26,29H,1,13,15-18H2;1H/q+1;/p-1/t20-,21+,25-,26+,28-;/m0./s1
InChIKey FCHYSBWCOKEPNQ-UDOJAKOWSA-M
Mol Weight 420.98 g/mol
Molecular Formula C26H29ClN2O
Exact Mass 420.196841 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID DKeGakoyiqe
Name (8S,9R)-(-)-N-Benzylcinchonidinium chloride
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 359580
CAS Registry Number 69257-04-1
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H29ClN2O
InChI InChI=1S/C26H29N2O.ClH/c1-2-20-18-28(17-19-8-4-3-5-9-19)15-13-21(20)16-25(28)26(29)23-12-14-27-24-11-7-6-10-22(23)24;/h2-12,14,20-21,25-26,29H,1,13,15-18H2;1H/q+1;/p-1/t20-,21+,25-,26+,28-;/m0./s1
InChIKey FCHYSBWCOKEPNQ-UDOJAKOWSA-M
Observed nucleus 1H
Purity 98%
Solvent DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms N-Benzylcinchonidinium chloride BCDC (R)-[(2S,4S,5R)-1-benzyl-5-ethenyl-1-azoniabicyclo[2.2.2]octan-2-yl]-quinolin-4-ylmethanol chloride
Wiley ID SIAL_1HNMR_007360