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thiocyanic acid, phenacyl ester

View entire compound with spectra: 6 NMR, and 1 FTIR

thiocyanic acid, phenacyl ester
SpectraBase Compound ID AUQCrxzG9Tf
InChI InChI=1S/C9H7NOS/c10-7-12-6-9(11)8-4-2-1-3-5-8/h1-5H,6H2
InChIKey DLLVIJACDVJDIP-UHFFFAOYSA-N
Mol Weight 177.22 g/mol
Molecular Formula C9H7NOS
Exact Mass 177.024835 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID yyEKfvYmHF
Name 1-PHENYL-2-THIOCYANATOETHANONE
Compound Number 16B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H7NOS
InChI InChI=1S/C9H7NOS/c10-7-12-6-9(11)8-4-2-1-3-5-8/h1-5H,6H2
InChIKey DLLVIJACDVJDIP-UHFFFAOYSA-N
Literature Reference Author S.LANASPEZE,R.NEIER
Literature Reference Citation MH.CHEM.,136,597(2005)
Literature Reference DOI 10.1007/s00706-004-0258-7
Molecular Weight 177.221 g/mol
Solvent CDCl3
Source File Reference UWSI23580