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5-tert-butyl-1-phenyl-1H-pyrazole-3-carboxylic acid
SpectraBase Compound ID 3iR9YMex3bA
InChI InChI=1S/C14H16N2O2/c1-14(2,3)12-9-11(13(17)18)15-16(12)10-7-5-4-6-8-10/h4-9H,1-3H3,(H,17,18)
InChIKey CBLDQVQVGAYZED-UHFFFAOYSA-N
Mol Weight 244.29 g/mol
Molecular Formula C14H16N2O2
Exact Mass 244.121178 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5C4Rl6PWBIv
Name 1H-pyrazole-3-carboxylic acid, 5-(1,1-dimethylethyl)-1-phenyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 244.121177761 u
Formula C14H16N2O2
InChI InChI=1S/C14H16N2O2/c1-14(2,3)12-9-11(13(17)18)15-16(12)10-7-5-4-6-8-10/h4-9H,1-3H3,(H,17,18)
InChIKey CBLDQVQVGAYZED-UHFFFAOYSA-N
Molecular Weight 244.294 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_16681
Solvent DMSO-d6
Source Vendor ID: NMR/10301929; Lab Info: KOB; Lab Number: KOB-M063KSH