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Thiocineole
SpectraBase Compound ID AcvZ9KxsXoE
InChI InChI=1S/C10H18S/c1-7-4-5-8-6-9(7)11-10(8,2)3/h7-9H,4-6H2,1-3H3
InChIKey FAXNZPOZWCWYBD-UHFFFAOYSA-N
Mol Weight 170.31 g/mol
Molecular Formula C10H18S
Exact Mass 170.112922 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID jTs3n4tvaB
Name 4,7,7-Trimethyl-6-thiabicyclo[3.2.1]octane
CAS Registry Number 84415-79-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H18S
InChI InChI=1S/C10H18S/c1-7-4-5-8-6-9(7)11-10(8,2)3/h7-9H,4-6H2,1-3H3
InChIKey FAXNZPOZWCWYBD-UHFFFAOYSA-N
Molecular Weight 170.314 g/mol
SMILES C1(SC2C(CCC1C2)C)(C)C
SPLASH splash10-0a4i-6900000000-24479e288a88a2127591
Source of Spectrum Va-0-0-0
Wiley ID 742135