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3-Nitrobenzoyl isothiocyanate
SpectraBase Compound ID L4wJ9BOHsXJ
InChI InChI=1S/C8H4N2O3S/c11-8(9-5-14)6-2-1-3-7(4-6)10(12)13/h1-4H
InChIKey BPIGGCBDZBMLCI-UHFFFAOYSA-N
Mol Weight 208.19 g/mol
Molecular Formula C8H4N2O3S
Exact Mass 207.994263 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 24GgOHDqw4e
Name 3-NITROBENZOYL ISOTHIOCYANATE
Comments 1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H4N2O3S
InChI InChI=1S/C8H4N2O3S/c11-8(9-5-14)6-2-1-3-7(4-6)10(12)13/h1-4H
InChIKey BPIGGCBDZBMLCI-UHFFFAOYSA-N
Instrument Name Tesla BS567A
Literature Reference I.DANIHEL, J.IMRICH, D.KOSCIK, P.KRISTIAN, G.BARANCIKOVA (1985)Coll.Czech.Chem.Comm.: v.50, N6, 1422-1431.
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d