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5-(1,1-Dimethylethyl)-1,3-dimethyl-2-thiabicyclo-[3.2.0]-hepta-3,6-diene-6,7-dicarbonitrile

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5-(1,1-Dimethylethyl)-1,3-dimethyl-2-thiabicyclo-[3.2.0]-hepta-3,6-diene-6,7-dicarbonitrile
SpectraBase Compound ID Ab9inyTnsHd
InChI InChI=1S/C14H16N2S/c1-9-6-14(12(2,3)4)11(8-16)10(7-15)13(14,5)17-9/h6H,1-5H3/t13-,14+/m1/s1
InChIKey GCKZZOAFYCATJT-KGLIPLIRSA-N
Mol Weight 244.36 g/mol
Molecular Formula C14H16N2S
Exact Mass 244.10342 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID eXKsbZ8Al1
Name 5-(1,1-Dimethylethyl)-1,3-dimethyl-2-thiabicyclo-[3.2.0]-hepta-3,6-diene-6,7-dicarbonitrile
CAS Registry Number 80242-88-2
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C14H16N2S
InChI InChI=1S/C14H16N2S/c1-9-6-14(12(2,3)4)11(8-16)10(7-15)13(14,5)17-9/h6H,1-5H3/t13-,14+/m1/s1
InChIKey GCKZZOAFYCATJT-KGLIPLIRSA-N
Instrument Name SF = 080 MHz
Literature Reference J. Org. Chem. 47, 967 (1982).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3