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1,3-Pentamethylene-benzimidazolethione
SpectraBase Compound ID FfTTMpOhrpu
InChI InChI=1S/C12H14N2S/c15-12-13-8-4-1-5-9-14(12)11-7-3-2-6-10(11)13/h2-3,6-7H,1,4-5,8-9H2
InChIKey ZRXLUPNSIPZNFG-UHFFFAOYSA-N
Mol Weight 218.32 g/mol
Molecular Formula C12H14N2S
Exact Mass 218.08777 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5Sdt9ukHcir
Name 1,3-Pentamethylene-benzimidazolethione
CAS Registry Number 50651-73-5
Comments SHIFT OF 201.4 PPM REPORTED FOR C1 SEEMS TO BE IN ERROR
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H14N2S
InChI InChI=1S/C12H14N2S/c15-12-13-8-4-1-5-9-14(12)11-7-3-2-6-10(11)13/h2-3,6-7H,1,4-5,8-9H2
InChIKey ZRXLUPNSIPZNFG-UHFFFAOYSA-N
Literature Reference R, Hayward, O. Meth-Cohn, J. Chem. Soc. Perkin I 219 (1975).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported