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METHYL-N-[2-(4-PHENOXYPHENOXY)-ETHYL]-DITHIOCARBAMATE
SpectraBase Compound ID G64WcTiHOr6
InChI InChI=1S/C16H17NO2S2/c1-21-16(20)17-11-12-18-13-7-9-15(10-8-13)19-14-5-3-2-4-6-14/h2-10H,11-12H2,1H3,(H,17,20)
InChIKey NTSMXSDKKDTSNT-UHFFFAOYSA-N
Mol Weight 319.44 g/mol
Molecular Formula C16H17NO2S2
Exact Mass 319.070071 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GATeLWgOCME
Name METHYL-N-[2-(4-PHENOXYPHENOXY)-ETHYL]-DITHIOCARBAMATE
Compound Number 121
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H17NO2S2
InChI InChI=1S/C16H17NO2S2/c1-21-16(20)17-11-12-18-13-7-9-15(10-8-13)19-14-5-3-2-4-6-14/h2-10H,11-12H2,1H3,(H,17,20)
InChIKey NTSMXSDKKDTSNT-UHFFFAOYSA-N
Literature Reference Author E.ELHALEM,B.N.BAILEY,R.DOCAMPO,I.UJVARY,S.H.SZAJNMAN,J.B.ROD RIGUEZ
Literature Reference Citation J.MED.CHEM.,45,3984(2002)
Literature Reference DOI 10.1021/jm0201518
Molecular Weight 319.436 g/mol
Sample ID 64974
Solvent CDCl3