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6-MERCAPTO-1,3,5-CYCLOHEPTATRIENE-1-ETHANETHIOL

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6-MERCAPTO-1,3,5-CYCLOHEPTATRIENE-1-ETHANETHIOL
SpectraBase Compound ID 5m9JopoCiUZ
InChI InChI=1S/C9H12S2/c10-6-5-8-3-1-2-4-9(11)7-8/h1-4,10-11H,5-7H2
InChIKey FMONHELXONLEMI-UHFFFAOYSA-N
Mol Weight 184.31 g/mol
Molecular Formula C9H12S2
Exact Mass 184.038043 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EhFfTZ8ZEoS
Name 6-MERCAPTO-1,3,5-CYCLOHEPTATRIENE-1-ETHANETHIOL
Source of Sample R. Okazaki, T. Hasegawa, Y. Shishido J. Amer. Chem. Soc. 106, 5271 (1984)
CAS Registry Number 90970-12-0
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12S2
InChI InChI=1S/C9H12S2/c10-6-5-8-3-1-2-4-9(11)7-8/h1-4,10-11H,5-7H2
InChIKey FMONHELXONLEMI-UHFFFAOYSA-N
Molecular Weight 184.32
Solvent Chloroform-d; Reference=TMS; Temperature=Ambient Spectrometer= Jeol GX-400
Synonyms CYCLOHEPTATRIENE-1-ETHANETHIOL, 1,3,5-, 6-MERCAPTO-,