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2,3-DIHYDRO-7-METHOXY-2,2-DIMETHYL-4H-1-BENZOTHIOPYRAN-4-ONE
SpectraBase Compound ID BQAPcSwpeS2
InChI InChI=1S/C12H14O2S/c1-12(2)7-10(13)9-5-4-8(14-3)6-11(9)15-12/h4-6H,7H2,1-3H3
InChIKey AWOGOLRECAWFCW-UHFFFAOYSA-N
Mol Weight 222.3 g/mol
Molecular Formula C12H14O2S
Exact Mass 222.071451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GHoBo18sch6
Name 7-methoxy-2,2-dimethyl-3H-1-benzothiopyran-4-one
CAS Registry Number 64793-90-4
Comments Less than 3 mono-isotopic peaks
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Formula C12H14O2S
InChI InChI=1S/C12H14O2S/c1-12(2)7-10(13)9-5-4-8(14-3)6-11(9)15-12/h4-6H,7H2,1-3H3
InChIKey AWOGOLRECAWFCW-UHFFFAOYSA-N
Molecular Weight 222.302 g/mol
SMILES c12c(C(=O)CC(S2)(C)C)ccc(c1)OC
SPLASH splash10-014i-0920000000-5d1bb917f033d6f2b4b5
Source of Spectrum Y-20-1116-0
Synonyms 7-methoxy-2,2-dimethyl-3H-thiochromen-4-one 7-methoxy-2,2-dimethyl-thiochroman-4-one
Wiley ID 1222121