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(S)-6-Chloro-4-thiochromanol
SpectraBase Compound ID E7Nfyg69qWv
InChI InChI=1S/C9H9ClOS/c10-6-1-2-9-7(5-6)8(11)3-4-12-9/h1-2,5,8,11H,3-4H2/t8-/m0/s1
InChIKey KGOKMXKVFZSSOE-QMMMGPOBSA-N
Mol Weight 200.68 g/mol
Molecular Formula C9H9ClOS
Exact Mass 200.006264 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DJcAow43Hgv
Name (S)-6-Chloro-4-thiochromanol
Alternate Name(s) (S)-6-chlorothiochroman-4-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9ClOS
InChI InChI=1S/C9H9ClOS/c10-6-1-2-9-7(5-6)8(11)3-4-12-9/h1-2,5,8,11H,3-4H2/t8-/m0/s1
InChIKey KGOKMXKVFZSSOE-QMMMGPOBSA-N
Literature Reference DOI 10.1002/cctc.201801602
Molecular Weight 200.683 g/mol
SMILES O[C@@]1(c2cc(ccc2SCC1)Cl)[H]
SPLASH splash10-0f8b-0910000000-fed64ecefc16c70f8ef2
Source of Spectrum CCC-11-SM11-6j
Wiley ID 1813293