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2-Tert-Butyl-3-methyl-4H-thiochromen-4-one
SpectraBase Compound ID 1YUhepq5chy
InChI InChI=1S/C14H16OS/c1-9-12(15)10-7-5-6-8-11(10)16-13(9)14(2,3)4/h5-8H,1-4H3
InChIKey SWGXIRAFQSRKIN-UHFFFAOYSA-N
Mol Weight 232.34 g/mol
Molecular Formula C14H16OS
Exact Mass 232.092186 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4YYI0xXD97Y
Name 2-Tert-Butyl-3-methyl-4H-thiochromen-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16OS
InChI InChI=1S/C14H16OS/c1-9-12(15)10-7-5-6-8-11(10)16-13(9)14(2,3)4/h5-8H,1-4H3
InChIKey SWGXIRAFQSRKIN-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol200336c
Molecular Weight 232.341 g/mol
SMILES c1cc2C(C(=C(Sc2cc1)C(C)(C)C)C)=O
SPLASH splash10-014i-0690000000-41c7462ccf576d0943a5
Source of Spectrum A1-13-1912/SMS12-5e
Synonyms 2-(tert-butyl)-3-methyl-4H-thiochromen-4-one
Wiley ID 1753009