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2-endo-Thiomethyl-bicyclo-[2.2.1]-5-heptene-2-exo-carboxylic-acid

View entire compound with spectra: 2 NMR

2-endo-Thiomethyl-bicyclo-[2.2.1]-5-heptene-2-exo-carboxylic-acid
SpectraBase Compound ID HNaRiniJcgv
InChI InChI=1S/C9H12O2S/c1-12-9(8(10)11)5-6-2-3-7(9)4-6/h2-3,6-7H,4-5H2,1H3,(H,10,11)/t6-,7+,9?/m0/s1
InChIKey OTJRFYHJNISREE-PMDVUHRTSA-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 3Zfv1cqBqai
Name 2-exo-Thiomethyl-bicyclo-[2.2.1]-5-heptene-2-endo-carboxylic-acid
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H12O2S
InChI InChI=1S/C9H12O2S/c1-12-9(8(10)11)5-6-2-3-7(9)4-6/h2-3,6-7H,4-5H2,1H3,(H,10,11)/t6-,7+,9?/m0/s1
InChIKey OTJRFYHJNISREE-PMDVUHRTSA-N
Instrument Name SF = 200 MHz
Literature Reference Tetrahedron 42, 3871 (1986).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3