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N-PARA-CHLORPHENYL-2-METHYL-4-(3,3,2,2-TETRACYANOPROP-1-YL)-BUTA-1,3-DIEN-1,4-SULTAMEN
SpectraBase Compound ID EbJZMm5l6xR
InChI InChI=1S/C18H12ClN5O2S/c1-13-6-17(7-18(11-22,12-23)14(8-20)9-21)24(27(25,26)10-13)16-4-2-15(19)3-5-16/h2-6,10,14H,7H2,1H3
InChIKey SRLAUSPCAQRAMF-UHFFFAOYSA-N
Mol Weight 397.84 g/mol
Molecular Formula C18H12ClN5O2S
Exact Mass 397.040024 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EWaL858ZGtD
Name N-PARA-CHLORPHENYL-2-METHYL-4-(3,3,2,2-TETRACYANOPROP-1-YL)-BUTA-1,3-DIEN-1,4-SULTAMEN
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H12ClN5O2S
InChI InChI=1S/C18H12ClN5O2S/c1-13-6-17(7-18(11-22,12-23)14(8-20)9-21)24(27(25,26)10-13)16-4-2-15(19)3-5-16/h2-6,10,14H,7H2,1H3
InChIKey SRLAUSPCAQRAMF-UHFFFAOYSA-N
Literature Reference Author E.FANGHAENEL,R.RADEGLIA,K.H.BEDEMANN,H.MOHAMMED,J.KRIWANEK,P .STEINMUELLER
Literature Reference Citation J.PRAKT.CHEM.,327,627(1985)
Literature Reference DOI 10.1002/prac.19853270413
Molecular Weight 397.839 g/mol
Solvent CD3NO2
Source File Reference UNIW19014