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1H-2-Benzothiopyran, 1-(4-methylphenyl)-
SpectraBase Compound ID AOi4cr7cZlj
InChI InChI=1S/C16H14S/c1-12-6-8-14(9-7-12)16-15-5-3-2-4-13(15)10-11-17-16/h2-11,16H,1H3
InChIKey SVZMNQMNEOTVMK-UHFFFAOYSA-N
Mol Weight 238.35 g/mol
Molecular Formula C16H14S
Exact Mass 238.081622 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FUM2G6LGwqG
Name 1H-2-Benzothiopyran, 1-(4-methylphenyl)-
CAS Registry Number 53512-30-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14S
InChI InChI=1S/C16H14S/c1-12-6-8-14(9-7-12)16-15-5-3-2-4-13(15)10-11-17-16/h2-11,16H,1H3
InChIKey SVZMNQMNEOTVMK-UHFFFAOYSA-N
Molecular Weight 238.348 g/mol
SMILES C1(c2c(cccc2)C=CS1)c1ccc(cc1)C
SPLASH splash10-000j-0390000000-aad556868abdc491b1e4
Source of Spectrum C-97-2736-0
Synonyms 1-(4-Methylphenyl)-1H-2-benzothiopyran 1-p-tolyl-2-thiochromene 4-p-tolyl-1-thio-2-chromene
Wiley ID 1241393