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4,5-Dimethyl-6,8-dioxa-3-thiabicyclo[3.2.1]octane 3-oxide
SpectraBase Compound ID 5vg2pd4t4Wv
InChI InChI=1S/C7H12O3S/c1-5-7(2)9-3-6(10-7)4-11(5)8/h5-6H,3-4H2,1-2H3/t5?,6-,7-,11?/m0/s1
InChIKey LWHMQBKBGPGXEU-UEOQTKNYSA-N
Mol Weight 176.23 g/mol
Molecular Formula C7H12O3S
Exact Mass 176.050715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IhUiCG6praF
Name 4,5-Dimethyl-6,8-dioxa-3-thiabicyclo[3.2.1]octane 3-oxide
CAS Registry Number 69697-56-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H12O3S
InChI InChI=1S/C7H12O3S/c1-5-7(2)9-3-6(10-7)4-11(5)8/h5-6H,3-4H2,1-2H3/t5?,6-,7-,11?/m0/s1
InChIKey LWHMQBKBGPGXEU-UEOQTKNYSA-N
Molecular Weight 176.230 g/mol
SMILES C1S(C([C@@]2(O[C@]1(CO2)[H])C)C)=O
SPLASH splash10-0006-9300000000-4d8344549f333d36bc5f
Source of Spectrum O-13-444-16
Synonyms 4.beta.,5-Dimethyl-6,8-dioxa-3-thiabicyclo(3,2,1)octane 3-oxide
Wiley ID 1171919