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1,1-Diketo-2-(4-methoxyphenyl)thiochromen-4-one
SpectraBase Compound ID FLtHk90NRr7
InChI InChI=1S/C16H12O4S/c1-20-12-8-6-11(7-9-12)16-10-14(17)13-4-2-3-5-15(13)21(16,18)19/h2-10H,1H3
InChIKey GJIGUORNXUXJKS-UHFFFAOYSA-N
Mol Weight 300.33 g/mol
Molecular Formula C16H12O4S
Exact Mass 300.04563 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8IA4OwEJZcj
Name 1,1-Diketo-2-(4-methoxyphenyl)thiochromen-4-one
CAS Registry Number 96156-22-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12O4S
InChI InChI=1S/C16H12O4S/c1-20-12-8-6-11(7-9-12)16-10-14(17)13-4-2-3-5-15(13)21(16,18)19/h2-10H,1H3
InChIKey GJIGUORNXUXJKS-UHFFFAOYSA-N
Molecular Weight 300.328 g/mol
SMILES C=1(S(c2c(C(C1)=O)cccc2)(=O)=O)c1ccc(cc1)OC
SPLASH splash10-0gb9-0926000000-5335ce8f5e4724f20827
Source of Spectrum Y-22-1594-12
Synonyms 2-(4-Methoxyphenyl)-1,1-bis(oxidanylidene)thiochromen-4-one 2-(4-Methoxyphenyl)-1,1-dioxo-1-benzothiopyran-4-one 2-(4-Methoxyphenyl)-1,1-dioxo-thiochromen-4-one
Wiley ID 1302686