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5-cyano-1-isopropyl-pyrazole-4-carboxylic acid ethyl ester
SpectraBase Compound ID CMZuLjtac7Z
InChI InChI=1S/C10H13N3O2/c1-4-15-10(14)8-6-12-13(7(2)3)9(8)5-11/h6-7H,4H2,1-3H3
InChIKey SAEASWWBIULHEA-UHFFFAOYSA-N
Mol Weight 207.23 g/mol
Molecular Formula C10H13N3O2
Exact Mass 207.100777 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GxT1TCGmjXF
Name 5-Cyano-1-isopropyl-1H-pyrazole-4-carboxylic aci D ethyl ester
CAS Registry Number 127553-52-0
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C10H13N3O2
InChI InChI=1S/C10H13N3O2/c1-4-15-10(14)8-6-12-13(7(2)3)9(8)5-11/h6-7H,4H2,1-3H3
InChIKey SAEASWWBIULHEA-UHFFFAOYSA-N
Instrument Name Bruker WM-250
Literature Reference G.E. Babbitt, M.P. Lynch, J.R.Beck, Magn. Res. Chem. 28, 90 (1990).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3