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1,2,3-Benzotrithiole

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1,2,3-Benzotrithiole
SpectraBase Compound ID 1oFu0jDwM6E
InChI InChI=1S/C6H4S3/c1-2-4-6-5(3-1)7-9-8-6/h1-4H
InChIKey IXJYHBIHBHISCC-UHFFFAOYSA-N
Mol Weight 172.28 g/mol
Molecular Formula C6H4S3
Exact Mass 171.947514 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8VAQj3V3QGO
Name 1,2,3-BENZOTRITHIOLE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C6H4S3
InChI InChI=1S/C6H4S3/c1-2-4-6-5(3-1)7-9-8-6/h1-4H
InChIKey IXJYHBIHBHISCC-UHFFFAOYSA-N
Literature Reference Author D.AEBISHER,E.M.BRZOSTOWSKA,N.SAWWAN,R.OVALLE,A.GREER
Literature Reference Citation J.NAT.PROD.,70,1492(2007)
Literature Reference DOI 10.1021/np070108t
Molecular Weight 172.278 g/mol
Sample ID 31566
Solvent CDCl3