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Ethoxycarbonylmethyl-dimethyl-[4-(3,3,11,11-tetramethyl-1,2-dithia-5,9-diaza-cycloundec-7-yl)-butyl]-ammonium

View entire compound with spectra: 1 NMR

Ethoxycarbonylmethyl-dimethyl-[4-(3,3,11,11-tetramethyl-1,2-dithia-5,9-diaza-cycloundec-7-yl)-butyl]-ammonium
SpectraBase Compound ID KL2cQyQYtme
InChI InChI=1S/C21H44N3O2S2.3BrH/c1-8-26-19(25)15-24(6,7)12-10-9-11-18-13-22-16-20(2,3)27-28-21(4,5)17-23-14-18;;;/h18,22-23H,8-17H2,1-7H3;3*1H/q+1;;;/p-1
InChIKey HGAICYYDVQCMCK-UHFFFAOYSA-M
Mol Weight 676.45 g/mol
Molecular Formula C21H46Br3N3O2S2
Exact Mass 673.058159 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BC1xt3b2CbM
Name Ethoxycarbonylmethyl-dimethyl-[4-(3,3,11,11-tetramethyl-1,2-dithia-5,9-diaza-cycloundec-7-yl)-butyl]-ammonium
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H46Br3N3O2S2
InChI InChI=1S/C21H44N3O2S2.3BrH/c1-8-26-19(25)15-24(6,7)12-10-9-11-18-13-22-16-20(2,3)27-28-21(4,5)17-23-14-18;;;/h18,22-23H,8-17H2,1-7H3;3*1H/q+1;;;/p-1
InChIKey HGAICYYDVQCMCK-UHFFFAOYSA-M
Instrument Name Bruker WM-250
NMR Standard CD3OD
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CD3OD