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CYCLOHEXYL-(R,S)-(-)-3-[2-(METHOXYMETHYL)-PYRROLIDIN-1-YLAMINO]-NONANE-1-SULFONATE
SpectraBase Compound ID 71WWiLStqo2
InChI InChI=1S/C21H42N2O4S/c1-3-4-5-7-11-19(22-23-16-10-12-20(23)18-26-2)15-17-28(24,25)27-21-13-8-6-9-14-21/h19-22H,3-18H2,1-2H3/t19-,20+/m1/s1
InChIKey QFSZNCDBOLPLJM-UXHICEINSA-N
Mol Weight 418.6 g/mol
Molecular Formula C21H42N2O4S
Exact Mass 418.286529 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GGrD1VoSDg1
Name CYCLOHEXYL-(R,S)-(-)-3-[2-(METHOXYMETHYL)-PYRROLIDIN-1-YLAMINO]-NONANE-1-SULFONATE
Compound Number 4D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H42N2O4S
InChI InChI=1S/C21H42N2O4S/c1-3-4-5-7-11-19(22-23-16-10-12-20(23)18-26-2)15-17-28(24,25)27-21-13-8-6-9-14-21/h19-22H,3-18H2,1-2H3/t19-,20+/m1/s1
InChIKey QFSZNCDBOLPLJM-UXHICEINSA-N
Literature Reference Author D.ENDERS,A.MOLL,J.W.BATS
Literature Reference Citation EUR.J.ORG.CHEM.,1271(2006)
Molecular Weight 418.635 g/mol
Sample ID 43358
Solvent CDCl3