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(E)-1-(2,6-Diiodo-4-nitro-phenyl)-3-(3-butyl-benzthiazolin-2-ylidene)-triazene
SpectraBase Compound ID Hb268Bnz6jT
InChI InChI=1S/C17H15I2N5O2S/c1-2-3-8-23-14-6-4-5-7-15(14)27-17(23)21-22-20-16-12(18)9-11(24(25)26)10-13(16)19/h4-7,9-10H,2-3,8H2,1H3/b21-17?,22-20+
InChIKey SIVVIQDMEVSKRI-QNUCEITMSA-N
Mol Weight 607.21 g/mol
Molecular Formula C17H15I2N5O2S
Exact Mass 606.903586 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AUQFTzN5yX6
Name (E)-1-(2,6-Diiodo-4-nitro-phenyl)-3-(3-butyl-benzthiazolin-2-ylidene)-triazene
Comments A NITROGEN 15N-LABELLED
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C17H15I2N5O2S
InChI InChI=1S/C17H15I2N5O2S/c1-2-3-8-23-14-6-4-5-7-15(14)27-17(23)21-22-20-16-12(18)9-11(24(25)26)10-13(16)19/h4-7,9-10H,2-3,8H2,1H3/b21-17?,22-20+
InChIKey SIVVIQDMEVSKRI-QNUCEITMSA-N
Instrument Name Bruker HX-90
Literature Reference S. Simova, E. Fanghaenel, R. Radeglia, Org. Magn. Resonance 21, 163 (1983).
NMR Standard (CH3)6 Si2O
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent Pyridine-D5