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4-(Trifluoromethyl)-benzoic-acid, methylester
SpectraBase Compound ID IxLlAmyDjRg
InChI InChI=1S/C9H7F3O2/c1-14-8(13)6-2-4-7(5-3-6)9(10,11)12/h2-5H,1H3
InChIKey VAZWXPJOOFSNLB-UHFFFAOYSA-N
Mol Weight 204.15 g/mol
Molecular Formula C9H7F3O2
Exact Mass 204.039814 g/mol

17O Nuclear Magnetic Resonance (NMR) Chemical Shifts

17O Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F3UbG4R6UNF
Name 4-(Trifluoromethyl)-benzoic-acid, methylester
CAS Registry Number 2967-66-0
Comments enrichment/labelling
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H7F3O2
InChI InChI=1S/C9H7F3O2/c1-14-8(13)6-2-4-7(5-3-6)9(10,11)12/h2-5H,1H3
InChIKey VAZWXPJOOFSNLB-UHFFFAOYSA-N
Instrument Name SF = 270 MHz
Literature Reference Org. Magn. Resonance 22, 753 (1984).
NMR Standard not reported
Observed nucleus 17O
Solvent Acetone