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3-Phenyl-1,6-dihydro-1,2,4,5-tetrazin
SpectraBase Compound ID JvmqQZBKOX7
InChI InChI=1S/C8H8N4/c1-2-4-7(5-3-1)8-11-9-6-10-12-8/h1-5,9H,6H2
InChIKey DUZRKBGIGOPDFQ-UHFFFAOYSA-N
Mol Weight 160.18 g/mol
Molecular Formula C8H8N4
Exact Mass 160.074896 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7fdOjIdswhC
Name 3-Phenyl-1,6-dihydro-1,2,4,5-tetrazin
CAS Registry Number 76630-74-5
Comments broad-band decoupling (BB)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H8N4
InChI InChI=1S/C8H8N4/c1-2-4-7(5-3-1)8-11-9-6-10-12-8/h1-5,9H,6H2
InChIKey DUZRKBGIGOPDFQ-UHFFFAOYSA-N
Instrument Name SF = 100 MHz
Literature Reference J. Org. Chem. 46, 3805 (1981).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CD3OD