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Adamantan-1-yl(trifluoromethyl)sulfane
SpectraBase Compound ID 1vql5MBgPWU
InChI InChI=1S/C11H15F3S/c12-11(13,14)15-10-4-7-1-8(5-10)3-9(2-7)6-10/h7-9H,1-6H2/t7-,8+,9-,10-
InChIKey CNIRLXQLHVEOQI-CHIWXEEVSA-N
Mol Weight 236.3 g/mol
Molecular Formula C11H15F3S
Exact Mass 236.084656 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7egH9MNsXkv
Name Adamantan-1-yl(trifluoromethyl)sulfane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H15F3S
InChI InChI=1S/C11H15F3S/c12-11(13,14)15-10-4-7-1-8(5-10)3-9(2-7)6-10/h7-9H,1-6H2/t7-,8+,9-,10-
InChIKey CNIRLXQLHVEOQI-CHIWXEEVSA-N
Literature Reference DOI 10.1002/anie.201402573
Molecular Weight 236.296 g/mol
SMILES C1[C@]2(C[C@]3(C[C@@]1(CC(C2)(C3)SC(F)(F)F)[H])[H])[H]
SPLASH splash10-000i-2900000000-5947a584b33ee9e17876
Source of Spectrum ACI-53-SM7-3a
Synonyms ((3s,5s,7s)-adamantan-1-yl)(trifluoromethyl)sulfane
Wiley ID 1782533