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2-(1-Ethoxyimino-butyl)-3-hydroxy-5-(3-thianyl)- 2-cyclohexene-1-one

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

2-(1-Ethoxyimino-butyl)-3-hydroxy-5-(3-thianyl)- 2-cyclohexene-1-one
SpectraBase Compound ID vPt9KqL3tD
InChI InChI=1S/C17H27NO3S/c1-3-6-14(18-21-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-22-11-12/h12-13,19H,3-11H2,1-2H3/b18-14+
InChIKey GGWHBJGBERXSLL-NBVRZTHBSA-N
Mol Weight 325.47 g/mol
Molecular Formula C17H27NO3S
Exact Mass 325.171165 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID I5fyZUcHcHM
Name 2-(1-Ethoxyimino-butyl)-3-hydroxy-5-(3-thianyl)- 2-cyclohexene-1-one
CAS Registry Number 101205-02-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C17H27NO3S
InChI InChI=1S/C17H27NO3S/c1-3-6-14(18-21-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-22-11-12/h12-13,19H,3-11H2,1-2H3/b18-14+
InChIKey GGWHBJGBERXSLL-NBVRZTHBSA-N
Instrument Name Bruker AM-270
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3