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N-Phenyl-2-methyl-4-(3,3,2,2-tetracyano-prop-1-yl)-buta-1,3-diene-1,4-sultame
SpectraBase Compound ID A9mhJS0ndQY
InChI InChI=1S/C18H13N5O2S/c1-14-7-17(8-18(12-21,13-22)15(9-19)10-20)23(26(24,25)11-14)16-5-3-2-4-6-16/h2-7,11,15H,8H2,1H3
InChIKey RFZRRAOTMPCMII-UHFFFAOYSA-N
Mol Weight 363.4 g/mol
Molecular Formula C18H13N5O2S
Exact Mass 363.078996 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BYf022pluki
Name N-Phenyl-2-methyl-4-(3,3,2,2-tetracyano-prop-1-yl)-buta-1,3-diene-1,4-sultame
CAS Registry Number 102118-43-4
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C18H13N5O2S
InChI InChI=1S/C18H13N5O2S/c1-14-7-17(8-18(12-21,13-22)15(9-19)10-20)23(26(24,25)11-14)16-5-3-2-4-6-16/h2-7,11,15H,8H2,1H3
InChIKey RFZRRAOTMPCMII-UHFFFAOYSA-N
Instrument Name Bruker HX-90
Literature Reference E. Fanghaenel, R. Radeglia, K.H. Bedemann, J. Prakt. Chem. 327, 627 (1985).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CD3NO2