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QLKRKOMMVAUYFB-PKNBQFBNSA-N

View entire compound with spectra: 1 NMR

QLKRKOMMVAUYFB-PKNBQFBNSA-N
SpectraBase Compound ID G2qxztZQ6rk
InChI InChI=1S/C12H17NOS/c1-10(2)13-9-11(3)15(14)12-7-5-4-6-8-12/h4-10,13H,1-3H3/b11-9+
InChIKey QLKRKOMMVAUYFB-PKNBQFBNSA-N
Mol Weight 223.33 g/mol
Molecular Formula C12H17NOS
Exact Mass 223.103085 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IVHHcdhjJoN
Name QLKRKOMMVAUYFB-PKNBQFBNSA-N
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H17NOS
InChI InChI=1S/C12H17NOS/c1-10(2)13-9-11(3)15(14)12-7-5-4-6-8-12/h4-10,13H,1-3H3/b11-9+
InChIKey QLKRKOMMVAUYFB-PKNBQFBNSA-N
Literature Reference Author Y.S.LIN,B.E.ALI,H.ALPER
Literature Reference Citation J.AM.CHEM.SOC.,123,7719(2001)
Literature Reference DOI 10.1021/ja010923+
Molecular Weight 223.333 g/mol
Solvent CDCl3
Source File Reference UWVN27820