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8-(Phenylamino)-3,4,5,6-tetrahydro-1,3,7-thiadiazocine-2-thione

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8-(Phenylamino)-3,4,5,6-tetrahydro-1,3,7-thiadiazocine-2-thione
SpectraBase Compound ID J2wtFr1ExLU
InChI InChI=1S/C11H13N3S2/c15-11-13-8-4-7-12-10(16-11)14-9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2,(H,12,14)(H,13,15)
InChIKey OPEBGBGBXYQJQY-UHFFFAOYSA-N
Mol Weight 251.37 g/mol
Molecular Formula C11H13N3S2
Exact Mass 251.05509 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AbetIgSZExm
Name 8-PHENYLAMINO-3,4,5,6-TETRAHYDRO-1,3,7-THIADIAZOCINE-2-THIONE
Compound Number 10A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H13N3S2
InChI InChI=1S/C11H13N3S2/c15-11-13-8-4-7-12-10(16-11)14-9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2,(H,12,14)(H,13,15)
InChIKey OPEBGBGBXYQJQY-UHFFFAOYSA-N
Literature Reference Author A.A.HASSAN,D.DOEPP
Literature Reference Citation J.HETCYCL.CHEM.,43,593(2006)
Literature Reference DOI 10.1002/jhet.5570430311
Molecular Weight 251.364 g/mol
Sample ID 67350
Solvent DMSO-D6