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3-Benzylthio-2-methyl-1,1-dideuterio-propanol

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3-Benzylthio-2-methyl-1,1-dideuterio-propanol
SpectraBase Compound ID AnhoHqMtcnn
InChI InChI=1S/C11H16OS/c1-10(7-12)8-13-9-11-5-3-2-4-6-11/h2-6,10,12H,7-9H2,1H3/i7D2
InChIKey KMFZGSTXBRPYKL-RJSZUWSASA-N
Mol Weight 198.32 g/mol
Molecular Formula C11H14D2OS
Exact Mass 198.10474 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LTlYGP0iF2F
Name 3-Benzylthio-2-methyl-1,1-dideuterio-propanol
CAS Registry Number 95552-95-7
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H14D2OS
InChI InChI=1S/C11H16OS/c1-10(7-12)8-13-9-11-5-3-2-4-6-11/h2-6,10,12H,7-9H2,1H3/i7D2
InChIKey KMFZGSTXBRPYKL-RJSZUWSASA-N
Instrument Name Bruker WM-250
Literature Reference E.L. Eliel, D.E. Knox, J. Am. Chem. Soc. 107, 2946 (1985).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3