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6,7-Dihydro-6,12-dimethyl-5H-dibenzo(B,G)(1,5)-thiazocine cation
SpectraBase Compound ID 9nooA1ExPOy
InChI InChI=1S/C16H18NS/c1-17-11-13-7-3-5-9-15(13)18(2)16-10-6-4-8-14(16)12-17/h3-10H,11-12H2,1-2H3/q+1
InChIKey QKVRNSBQTKKKDD-UHFFFAOYSA-N
Mol Weight 256.39 g/mol
Molecular Formula C16H18NS
Exact Mass 256.115996 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JBatyVeCMyP
Name 6,7-Dihydro-6,12-dimethyl-5H-dibenzo(B,G)(1,5)-thiazocine cation
CAS Registry Number 87532-43-2
Comments PF6-SALT, HITACHI R-90H SPECTROMETER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C16H18NS
InChI InChI=1S/C16H18NS/c1-17-11-13-7-3-5-9-15(13)18(2)16-10-6-4-8-14(16)12-17/h3-10H,11-12H2,1-2H3/q+1
InChIKey QKVRNSBQTKKKDD-UHFFFAOYSA-N
Instrument Name see comment
Literature Reference K. Akiba, K. Takee, Y. Shimizu, J. Am. Chem. Soc. 108, 6320 (1986).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CH3CN