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3-(ethoxy-phenylmethyl)thiochromen-4-one
SpectraBase Compound ID 2rYdJNz6WAN
InChI InChI=1S/C18H16O2S/c1-2-20-18(13-8-4-3-5-9-13)15-12-21-16-11-7-6-10-14(16)17(15)19/h3-12,18H,2H2,1H3
InChIKey BCJGZMLGVSQNEI-UHFFFAOYSA-N
Mol Weight 296.38 g/mol
Molecular Formula C18H16O2S
Exact Mass 296.087101 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KgesEO8hsUh
Name 3-[ethoxy(phenyl)methyl]-1-benzothiopyran-4-one
Alternate Name(s) 3-[ethoxy(phenyl)methyl]thiochromen-4-one
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Formula C18H16O2S
InChI InChI=1S/C18H16O2S/c1-2-20-18(13-8-4-3-5-9-13)15-12-21-16-11-7-6-10-14(16)17(15)19/h3-12,18H,2H2,1H3
InChIKey BCJGZMLGVSQNEI-UHFFFAOYSA-N
Molecular Weight 296.384 g/mol
SMILES C=1(C(c2ccccc2SC1)=O)C(c1ccccc1)OCC
SPLASH splash10-014r-3790000000-1c6f47502292eb5eb5b9
Source of Spectrum KC-57-2905-38
Wiley ID 1623705