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1-Acetyl-4,4-dideuterio-tetrahydropyridine
SpectraBase Compound ID AZo6wkg5e1R
InChI InChI=1S/C7H11NO/c1-7(9)8-5-3-2-4-6-8/h3,5H,2,4,6H2,1H3/i2D2
InChIKey ZGKNRILGBQAZDJ-CBTSVUPCSA-N
Mol Weight 127.18 g/mol
Molecular Formula C7H9D2NO
Exact Mass 127.096617 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3VoFJrW0p1S
Name 1-Acetyl-4,4-dideuterio-tetrahydropyridine
CAS Registry Number 94474-78-9
Comments MINOR ISOMER, C3 SHIFT FROM NON-DEUTERIATED ANALOGUE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C7H9D2NO
InChI InChI=1S/C7H11NO/c1-7(9)8-5-3-2-4-6-8/h3,5H,2,4,6H2,1H3/i2D2
InChIKey ZGKNRILGBQAZDJ-CBTSVUPCSA-N
Instrument Name Bruker HX-60
Literature Reference B.M. Pinto, W.A. Szarek, T.B. Grindley, Org. Magn. Resonance 22, 676 (1984).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3