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Ethyl 2,4-diphenyl-2H-1-benzothiopyran-3-carboxylate
SpectraBase Compound ID LQLqNK06Nkv
InChI InChI=1S/C24H20O2S/c1-2-26-24(25)22-21(17-11-5-3-6-12-17)19-15-9-10-16-20(19)27-23(22)18-13-7-4-8-14-18/h3-16,23H,2H2,1H3
InChIKey KKLLNYRUQUMELZ-UHFFFAOYSA-N
Mol Weight 372.48 g/mol
Molecular Formula C24H20O2S
Exact Mass 372.118401 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G5HM0C8rujQ
Name Ethyl 2,4-diphenyl-2H-1-benzothiopyran-3-carboxylate
Alternate Name(s) 2,4-diphenyl-2H-1-benzothiopyran-3-carboxylic acid ethyl ester ethyl 2,4-diphenyl-2H-thiochromene-3-carboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C24H20O2S
InChI InChI=1S/C24H20O2S/c1-2-26-24(25)22-21(17-11-5-3-6-12-17)19-15-9-10-16-20(19)27-23(22)18-13-7-4-8-14-18/h3-16,23H,2H2,1H3
InChIKey KKLLNYRUQUMELZ-UHFFFAOYSA-N
Molecular Weight 372.482 g/mol
SMILES C1(=C(c2ccccc2SC1c1ccccc1)c1ccccc1)C(=O)OCC
SPLASH splash10-00di-0091000000-bcf6cf1f4c2c8d758bab
Source of Spectrum KC-0-1551-31
Wiley ID 828050