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3-(4-Fluorobenzyl)-1H-isochromene-1-thione
SpectraBase Compound ID E4xuY5NRXk4
InChI InChI=1S/C16H11FOS/c17-13-7-5-11(6-8-13)9-14-10-12-3-1-2-4-15(12)16(19)18-14/h1-8,10H,9H2
InChIKey OSBFAKBPPYINIL-UHFFFAOYSA-N
Mol Weight 270.32 g/mol
Molecular Formula C16H11FOS
Exact Mass 270.051464 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Z2CAgfqgz1
Name 3-(4-Fluorobenzyl)-1H-isochromene-1-thione
Alternate Name(s) 3-[(4-fluorophenyl)methyl]-2-benzopyran-1-thione 3-[(4-fluorophenyl)methyl]isochromene-1-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H11FOS
InChI InChI=1S/C16H11FOS/c17-13-7-5-11(6-8-13)9-14-10-12-3-1-2-4-15(12)16(19)18-14/h1-8,10H,9H2
InChIKey OSBFAKBPPYINIL-UHFFFAOYSA-N
Molecular Weight 270.321 g/mol
SMILES C1(OC(Cc2ccc(cc2)F)=Cc2c1cccc2)=S
SPLASH splash10-0229-0790000000-fc8d93fa76adff6d57a5
Source of Spectrum Y-45-681-2i
Wiley ID 1666001