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5,9,9-Trimethyl-1-thia-spiro[5.5]undec-3-en-7,11-dione
SpectraBase Compound ID CZ1sj6XvCIi
InChI InChI=1S/C13H18O2S/c1-9-5-4-6-16-13(9)10(14)7-12(2,3)8-11(13)15/h4-5,9H,6-8H2,1-3H3
InChIKey FSJGXKYOEBUJQD-UHFFFAOYSA-N
Mol Weight 238.34 g/mol
Molecular Formula C13H18O2S
Exact Mass 238.102751 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2k7LhOJ8ls
Name 5,9,9-Trimethyl-1-thia-spiro[5.5]undec-3-en-7,11-dione
Comments Less than 3 mono-isotopic peaks
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Formula C13H18O2S
InChI InChI=1S/C13H18O2S/c1-9-5-4-6-16-13(9)10(14)7-12(2,3)8-11(13)15/h4-5,9H,6-8H2,1-3H3
InChIKey FSJGXKYOEBUJQD-UHFFFAOYSA-N
Molecular Weight 238.345 g/mol
SMILES C12(C(CC(CC2=O)(C)C)=O)SCC=CC1C
SPLASH splash10-001r-9095000000-a8c1cf3f5cb265ed415b
Source of Spectrum J-73-7465-29c
Synonyms 2,9,9-Trimethyl-1-thia-aspiro[5.5]undec-3-en-7,11-dione
Wiley ID 1668652