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(1R,3S,4S,5S)-(+)-4-(1-Methylethyl)-1,8,8-trimethyl-3-thiabicyclo[3.2.1]octane-3-oxide

View entire compound with spectra: 1 MS (GC)

(1R,3S,4S,5S)-(+)-4-(1-Methylethyl)-1,8,8-trimethyl-3-thiabicyclo[3.2.1]octane-3-oxide
SpectraBase Compound ID IBCDW1YQ7x3
InChI InChI=1S/C13H24OS/c1-9(2)11-10-6-7-13(5,8-15(11)14)12(10,3)4/h9-11H,6-8H2,1-5H3/t10-,11+,13+,15?/m1/s1
InChIKey DNGJTHQORHAPST-GXBCUXGNSA-N
Mol Weight 228.39 g/mol
Molecular Formula C13H24OS
Exact Mass 228.154787 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AchThXCrE1J
Name (1R,3S,4S,5S)-(+)-4-(1-Methylethyl)-1,8,8-trimethyl-3-thiabicyclo[3.2.1]octane-3-oxide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H24OS
InChI InChI=1S/C13H24OS/c1-9(2)11-10-6-7-13(5,8-15(11)14)12(10,3)4/h9-11H,6-8H2,1-5H3/t10-,11+,13+,15?/m1/s1
InChIKey DNGJTHQORHAPST-GXBCUXGNSA-N
Molecular Weight 228.394 g/mol
SMILES [C@@]1([S@](C[C@@]2(CC[C@]1(C2(C)C)[H])C)=O)(C(C)C)[H]
SPLASH splash10-0bt9-9760000000-fbf00627544bbf8eff52
Source of Spectrum F-50-6071-9
Synonyms (1R,4S,5S)-4-isopropyl-1,8,8-trimethyl-3-thiabicyclo[3.2.1]octane 3-oxide
Wiley ID 1229739