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YTXMCWVVOOZDFJ-VXNVDRBHSA-N
SpectraBase Compound ID 6bXEe7ynVab
InChI InChI=1S/C9H9NOS/c10-6-9(4-7(9)5-11)8-2-1-3-12-8/h1-3,7,11H,4-5H2/t7-,9-/m1/s1
InChIKey YTXMCWVVOOZDFJ-VXNVDRBHSA-N
Mol Weight 179.24 g/mol
Molecular Formula C9H9NOS
Exact Mass 179.040485 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BtRjt4nIoTZ
Name YTXMCWVVOOZDFJ-VXNVDRBHSA-N
Compound Number 7A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H9NOS
InChI InChI=1S/C9H9NOS/c10-6-9(4-7(9)5-11)8-2-1-3-12-8/h1-3,7,11H,4-5H2/t7-,9-/m1/s1
InChIKey YTXMCWVVOOZDFJ-VXNVDRBHSA-N
Literature Reference Author P.LANGER,I.FREIFELD
Literature Reference Citation ORG.LETTERS,3,3903(2001)
Literature Reference DOI 10.1021/ol010207c
Molecular Weight 179.237 g/mol
Solvent CDCl3
Source File Reference UWLU33965