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3-(4-Methoxyphenyl)-1H-isochromene-1-thione
SpectraBase Compound ID J4RDyiXte8M
InChI InChI=1S/C16H12O2S/c1-17-13-8-6-11(7-9-13)15-10-12-4-2-3-5-14(12)16(19)18-15/h2-10H,1H3
InChIKey XYTKNWYWECMBKN-UHFFFAOYSA-N
Mol Weight 268.33 g/mol
Molecular Formula C16H12O2S
Exact Mass 268.055801 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JQeG6eQ2rJu
Name 3-(4-Methoxyphenyl)-1H-isochromene-1-thione
Alternate Name(s) 3-(4-Methoxyphenyl)-2-benzopyran-1-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12O2S
InChI InChI=1S/C16H12O2S/c1-17-13-8-6-11(7-9-13)15-10-12-4-2-3-5-14(12)16(19)18-15/h2-10H,1H3
InChIKey XYTKNWYWECMBKN-UHFFFAOYSA-N
Molecular Weight 268.330 g/mol
SMILES C1(OC(c2ccc(cc2)OC)=Cc2c1cccc2)=S
SPLASH splash10-07vi-0980000000-22890362e5cdfa5f2209
Source of Spectrum Y-45-681-2h
Wiley ID 1666002