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3-cyano-1-(1,1,3,3-tetramethylbutyl)pyrazole-4-carboxylic acid ethyl ester
SpectraBase Compound ID ELzeVAQCLRK
InChI InChI=1S/C15H23N3O2/c1-7-20-13(19)11-9-18(17-12(11)8-16)15(5,6)10-14(2,3)4/h9H,7,10H2,1-6H3
InChIKey IVSMRAVXVTXJPD-UHFFFAOYSA-N
Mol Weight 277.37 g/mol
Molecular Formula C15H23N3O2
Exact Mass 277.179027 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ADj2VRtpBTK
Name 3-Cyano-1-(1,1,3,3-tetramethyl-butyl)-1H-pyrazol E-4-carboxylic acid, ethyl ester
CAS Registry Number 127526-77-6
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C15H23N3O2
InChI InChI=1S/C15H23N3O2/c1-7-20-13(19)11-9-18(17-12(11)8-16)15(5,6)10-14(2,3)4/h9H,7,10H2,1-6H3
InChIKey IVSMRAVXVTXJPD-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