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4,4,5-Trimethyl-6,8-dioxa-3-thiabicyclo[3.2.1]octane
SpectraBase Compound ID 5NMa0F31SXK
InChI InChI=1S/C8H14O2S/c1-7(2)8(3)9-4-6(10-8)5-11-7/h6H,4-5H2,1-3H3/t6-,8-/m1/s1
InChIKey GVUDOWQPVVUZDI-HTRCEHHLSA-N
Mol Weight 174.26 g/mol
Molecular Formula C8H14O2S
Exact Mass 174.071451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CjAjIcSeswz
Name 4,4,5-Trimethyl-6,8-dioxa-3-thiabicyclo[3.2.1]octane
CAS Registry Number 69697-53-6
Comments Less than 3 mono-isotopic peaks
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Formula C8H14O2S
InChI InChI=1S/C8H14O2S/c1-7(2)8(3)9-4-6(10-8)5-11-7/h6H,4-5H2,1-3H3/t6-,8-/m1/s1
InChIKey GVUDOWQPVVUZDI-HTRCEHHLSA-N
Molecular Weight 174.258 g/mol
SMILES [C@]12(O[C@](CO2)(CSC1(C)C)[H])C
SPLASH splash10-00di-9300000000-fbfc54f9fa86b7871fe5
Source of Spectrum K-2001-2617-32
Synonyms (1R,5R)-4,4,5-Trimethyl-6,8-dioxa-3-thiabicyclo[3.2.1]octane 4,4,5-Trimethyl-6,8-dioxa-3-thia-bicyclo(3,2,1)ctane
Wiley ID 1579778