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(7R)-7-Hydroxymethyl-7-methylthio-bicyclo(2.2.1)hept-2-en-5-one

View entire compound with spectra: 2 NMR

(7R)-7-Hydroxymethyl-7-methylthio-bicyclo(2.2.1)hept-2-en-5-one
SpectraBase Compound ID Hqj6ImBekZN
InChI InChI=1S/C9H12O2S/c1-12-9(5-10)6-2-3-7(9)8(11)4-6/h2-3,6-7,10H,4-5H2,1H3/t6-,7+,9-/m1/s1
InChIKey GSEBPVWTCFXEHZ-BKPPORCPSA-N
Mol Weight 184.25 g/mol
Molecular Formula C9H12O2S
Exact Mass 184.055801 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BHbUVM9Jl8M
Name (7S)-7-Hydroxymethyl-7-methylthio-bicyclo(2.2.1)hept-2-en-5-one
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H12O2S
InChI InChI=1S/C9H12O2S/c1-12-9(5-10)6-2-3-7(9)8(11)4-6/h2-3,6-7,10H,4-5H2,1H3/t6-,7+,9-/m1/s1
InChIKey GSEBPVWTCFXEHZ-BKPPORCPSA-N
Instrument Name Varian FT-80
Literature Reference L.A. Paquette, K.S. Learn, J.L.Romine, J. Am. Chem. Soc. 110, 879 (1988).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3