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(2-Trideuteriomethyl-furyl)-dideuteriomethyl benzoate

View entire compound with spectra: 1 NMR

(2-Trideuteriomethyl-furyl)-dideuteriomethyl benzoate
SpectraBase Compound ID KITCZ2cbqEv
InChI InChI=1S/C13H12O3/c1-10-12(7-8-15-10)9-16-13(14)11-5-3-2-4-6-11/h2-8H,9H2,1H3/i1D3,9D2
InChIKey PJOZSQWUXUSUFH-UFFRDWFDSA-N
Mol Weight 221.27 g/mol
Molecular Formula C13H7D5O3
Exact Mass 221.110028 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8aVdJ71Ge5q
Name (2-Trideuteriomethyl-furyl)-dideuteriomethyl benzoate
CAS Registry Number 101980-34-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H7D5O3
InChI InChI=1S/C13H12O3/c1-10-12(7-8-15-10)9-16-13(14)11-5-3-2-4-6-11/h2-8H,9H2,1H3/i1D3,9D2
InChIKey PJOZSQWUXUSUFH-UFFRDWFDSA-N
Instrument Name Jeol FX-90
Literature Reference C.H. Chou, W.S. Trahanovsky, J. Am. Chem. Soc. 108, 4138 (1986).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3