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11,12-DIHYDRO-6H-6,12-METHANODIBENZO[B,F]THIOCIN-12-CARBONITRILE
SpectraBase Compound ID 3sc4DGqM13U
InChI InChI=1S/C17H13NS/c18-11-17-9-12-5-1-2-6-13(12)16(10-17)19-15-8-4-3-7-14(15)17/h1-8,16H,9-10H2
InChIKey FXQITUWQPVKJFE-UHFFFAOYSA-N
Mol Weight 263.36 g/mol
Molecular Formula C17H13NS
Exact Mass 263.076871 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7YlN24cQvLq
Name 11,12-DIHYDRO-6H-6,12-METHANODIBENZO[B,F]THIOCIN-12-CARBONITRILE
Comments 1
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C17H13NS
InChI InChI=1S/C17H13NS/c18-11-17-9-12-5-1-2-6-13(12)16(10-17)19-15-8-4-3-7-14(15)17/h1-8,16H,9-10H2
InChIKey FXQITUWQPVKJFE-UHFFFAOYSA-N
Instrument Name Varian XL-200
Literature Reference K.SINDELAR, M.BUDESINSKY, T.VANEK, J.HOLUBEK, E.SVATEK, O.MATOUSOVA, CH.W.REES,M.PROTIVA (1987) Coll.Czech.Chem.Comm.: v.52, N9, 2281-2294.
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d