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3-(4-Fluorobenzoyl)propionic acid

View entire compound with spectra: 3 NMR, 5 FTIR, 2 Raman, 1 UV-Vis, and 4 MS (GC)

3-(4-Fluorobenzoyl)propionic acid
SpectraBase Compound ID 8sCDcWUnHYB
InChI InChI=1S/C10H9FO3/c11-8-3-1-7(2-4-8)9(12)5-6-10(13)14/h1-4H,5-6H2,(H,13,14)
InChIKey WUYWHIAAQYQKPP-UHFFFAOYSA-N
Mol Weight 196.18 g/mol
Molecular Formula C10H9FO3
Exact Mass 196.053572 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3Lg7azTHMJm
Name 3-(4-Fluorobenzoyl)propionic acid
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 176478
CAS Registry Number 366-77-8
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H9FO3
InChI InChI=1S/C10H9FO3/c11-8-3-1-7(2-4-8)9(12)5-6-10(13)14/h1-4H,5-6H2,(H,13,14)
InChIKey WUYWHIAAQYQKPP-UHFFFAOYSA-N
Observed nucleus 13C
Purity 97%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms Haloperidol metabolite III R 11302
Wiley ID SIAL_13CNMR_002142