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3-isoxazolebutanoic acid, 5-(4-methylphenyl)-

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3-isoxazolebutanoic acid, 5-(4-methylphenyl)-
SpectraBase Compound ID 3GKlAy57uih
InChI InChI=1S/C14H15NO3/c1-10-5-7-11(8-6-10)13-9-12(15-18-13)3-2-4-14(16)17/h5-9H,2-4H2,1H3,(H,16,17)
InChIKey HIAAJLGQEMGOMC-UHFFFAOYSA-N
Mol Weight 245.28 g/mol
Molecular Formula C14H15NO3
Exact Mass 245.105193 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CNbyVZS7x6c
Name 3-isoxazolebutanoic acid, 5-(4-methylphenyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 245.105193344 u
Formula C14H15NO3
InChI InChI=1S/C14H15NO3/c1-10-5-7-11(8-6-10)13-9-12(15-18-13)3-2-4-14(16)17/h5-9H,2-4H2,1H3,(H,16,17)
InChIKey HIAAJLGQEMGOMC-UHFFFAOYSA-N
Molecular Weight 245.278 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_680
Solvent DMSO-d6
Source Vendor ID: NMR/12669414