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VCGUTLICLVHWNJ-CWKFCGSDSA-N

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VCGUTLICLVHWNJ-CWKFCGSDSA-N
SpectraBase Compound ID 82UYiyOXKlw
InChI InChI=1S/C9H11NOS/c12-9-10-8-6-2-1-5(3-6)7(8)4-11-9/h1-2,5-8H,3-4H2,(H,10,12)/t5-,6+,7-,8+/m1/s1
InChIKey VCGUTLICLVHWNJ-CWKFCGSDSA-N
Mol Weight 181.25 g/mol
Molecular Formula C9H11NOS
Exact Mass 181.056135 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DKr7Vjp1uMl
Name VCGUTLICLVHWNJ-CWKFCGSDSA-N
Compound Number 8A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H11NOS
InChI InChI=1S/C9H11NOS/c12-9-10-8-6-2-1-5(3-6)7(8)4-11-9/h1-2,5-8H,3-4H2,(H,10,12)/t5-,6+,7-,8+/m1/s1
InChIKey VCGUTLICLVHWNJ-CWKFCGSDSA-N
Literature Reference Author P.SOHAR,I.PELCZER,G.STAJER,G.BERNATH
Literature Reference Citation MAGN.RES.CHEM.,25,584(1987)
Literature Reference DOI 10.1002/mrc.1260250707
Molecular Weight 181.252 g/mol
Solvent CDCl3
Source File Reference UWGB397