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benzenecarbothioic acid S-(2-acetylphenyl) ester
SpectraBase Compound ID 6XjoSsNucHX
InChI InChI=1S/C15H12O2S/c1-11(16)13-9-5-6-10-14(13)18-15(17)12-7-3-2-4-8-12/h2-10H,1H3
InChIKey KHVPSNHOTHMGAZ-UHFFFAOYSA-N
Mol Weight 256.32 g/mol
Molecular Formula C15H12O2S
Exact Mass 256.055801 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 71WP4LUP0rg
Name benzenecarbothioic acid S-(2-acetylphenyl) ester
Comments Less than 3 mono-isotopic peaks
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Formula C15H12O2S
InChI InChI=1S/C15H12O2S/c1-11(16)13-9-5-6-10-14(13)18-15(17)12-7-3-2-4-8-12/h2-10H,1H3
InChIKey KHVPSNHOTHMGAZ-UHFFFAOYSA-N
Molecular Weight 256.319 g/mol
SMILES C(Sc1c(C(=O)C)cccc1)(=O)c1ccccc1
SPLASH splash10-0a4i-0900000000-f6a388e60436c72b3266
Source of Spectrum D1-2001-1958-8
Synonyms S-(2-acetylphenyl) benzenecarbothioate S-(2-ethanoylphenyl) benzenecarbothioate thiobenzoic acid S-(2-acetylphenyl) ester
Wiley ID 851213