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5,6-DIHYDROPYRROLO-[1,2-A]-[3,1,6]-THIADIAZOCINE
SpectraBase Compound ID 2mhfeC4eldR
InChI InChI=1S/C12H10N2OS/c15-11-8-16-12-6-3-7-14(12)10-5-2-1-4-9(10)13-11/h1-7H,8H2,(H,13,15)
InChIKey NNXVSNGQBHLHLW-UHFFFAOYSA-N
Mol Weight 230.28 g/mol
Molecular Formula C12H10N2OS
Exact Mass 230.051384 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID MiAWKpKlUR
Name 5,6-DIHYDROPYRROLO-[1,2-A]-[3,1,6]-THIADIAZOCINE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H10N2OS
InChI InChI=1S/C12H10N2OS/c15-11-8-16-12-6-3-7-14(12)10-5-2-1-4-9(10)13-11/h1-7H,8H2,(H,13,15)
InChIKey NNXVSNGQBHLHLW-UHFFFAOYSA-N
Literature Reference Author G.W.H.CHEESEMAN,A.A.HAWI,G.VARVOUNIS
Literature Reference Citation J.HETCYCL.CHEM.,22,423(1985)
Literature Reference DOI 10.1002/jhet.5570220241
Molecular Weight 230.284 g/mol
Solvent DMSO-D6
Source File Reference UWED12126