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4H-naphtho[1,2-b]thiopyran-4-one, 2-(2,5-dimethylphenyl)-
SpectraBase Compound ID CKYWl9pVrSS
InChI InChI=1S/C21H16OS/c1-13-7-8-14(2)18(11-13)20-12-19(22)17-10-9-15-5-3-4-6-16(15)21(17)23-20/h3-12H,1-2H3
InChIKey CSXAQWRKBUEHJW-UHFFFAOYSA-N
Mol Weight 316.42 g/mol
Molecular Formula C21H16OS
Exact Mass 316.092186 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 14u0ibrZcSc
Name 4H-naphtho[1,2-b]thiopyran-4-one, 2-(2,5-dimethylphenyl)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H16OS
InChI InChI=1S/C21H16OS/c1-13-7-8-14(2)18(11-13)20-12-19(22)17-10-9-15-5-3-4-6-16(15)21(17)23-20/h3-12H,1-2H3
InChIKey CSXAQWRKBUEHJW-UHFFFAOYSA-N
Molecular Weight 316.418 g/mol
SMILES Cc1ccc(C)c(c1)C1=CC(=O)c2ccc3ccccc3c2S1
SPLASH splash10-014i-0759000000-b6b3365215401eef0fff
Source of Spectrum JX-2015-3-127
Synonyms 2-(2,5-dimethylphenyl)-4H-benzo[h]thiochromen-4-one 2-(2,5-dimethylphenyl)-4-benzo[h]thiochromenone
Wiley ID 1723726