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3-((Trifluoromethyl)thio)adamantan-1-ol
SpectraBase Compound ID HcODr3BpYm9
InChI InChI=1S/C11H15F3OS/c12-11(13,14)16-10-4-7-1-8(5-10)3-9(15,2-7)6-10/h7-8,15H,1-6H2/t7-,8+,9+,10-
InChIKey ZJFCHRPKFNYIEU-FIRGSJFUSA-N
Mol Weight 252.3 g/mol
Molecular Formula C11H15F3OS
Exact Mass 252.079571 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2dP1TnS2ruQ
Name 3-((Trifluoromethyl)thio)adamantan-1-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H15F3OS
InChI InChI=1S/C11H15F3OS/c12-11(13,14)16-10-4-7-1-8(5-10)3-9(15,2-7)6-10/h7-8,15H,1-6H2/t7-,8+,9+,10-
InChIKey ZJFCHRPKFNYIEU-FIRGSJFUSA-N
Literature Reference DOI 10.1002/anie.201402573
Molecular Weight 252.295 g/mol
SMILES O[C@]12C[C@@]3(C[C@](C2)(C[C@](C3)(C1)SC(F)(F)F)[H])[H]
SPLASH splash10-0udi-2910000000-4ed4b8224c9498e8559b
Source of Spectrum ACI-53-SM8-3c
Synonyms (1r,3s,5R,7S)-3-((trifluoromethyl)thio)adamantan-1-ol
Wiley ID 1782535