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3,5-dimethyl-4-iodopyrazole
SpectraBase Compound ID 94pOYNbCj4A
InChI InChI=1S/C5H7IN2/c1-3-5(6)4(2)8-7-3/h1-2H3,(H,7,8)
InChIKey MZZXIXHKDJNBJQ-UHFFFAOYSA-N
Mol Weight 222.03 g/mol
Molecular Formula C5H7IN2
Exact Mass 221.965393 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C8yn5gzzErB
Name 4-Iodo-3,5-dimethyl-pyrazole
CAS Registry Number 2033-45-6
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C5H7IN2
InChI InChI=1S/C5H7IN2/c1-3-5(6)4(2)8-7-3/h1-2H3,(H,7,8)
InChIKey MZZXIXHKDJNBJQ-UHFFFAOYSA-N
Instrument Name Bruker WP-80
Literature Reference P. Cabildo, R.M. Claramunt, J. Elguero, Org. Magn. Resonance 22, 603 (1984).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6