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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 4XoSf2Byi7t
Name 4,4,5-Trimethyl-6,8-dioxa-3-thiabicyclo[3.2.1]octane
CAS Registry Number 69697-53-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
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 C1([C@]2(O[C@@](CS1)(CO2)[H])C)(C)C
SPLASH splash10-00di-9100000000-35675563abb0093e9974
Source of Spectrum O-13-440-8
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 1170231