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1,3-Benzoxathiol-2-one, 5-hydroxy-4-methyl-7-(1-methylethyl)-
SpectraBase Compound ID DXS39xqHOyG
InChI InChI=1S/C11H12O3S/c1-5(2)7-4-8(12)6(3)10-9(7)14-11(13)15-10/h4-5,12H,1-3H3
InChIKey GYRLRHWLXLICDZ-UHFFFAOYSA-N
Mol Weight 224.27 g/mol
Molecular Formula C11H12O3S
Exact Mass 224.050715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2sKjPnkUNs
Name 1,3-Benzoxathiol-2-one, 5-hydroxy-4-methyl-7-(1-methylethyl)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12O3S
InChI InChI=1S/C11H12O3S/c1-5(2)7-4-8(12)6(3)10-9(7)14-11(13)15-10/h4-5,12H,1-3H3
InChIKey GYRLRHWLXLICDZ-UHFFFAOYSA-N
Molecular Weight 224.274 g/mol
SMILES Oc1cc(C(C)C)c2c(c1C)SC(=O)O2
SPLASH splash10-01b9-2940000000-4cbac32f8cb121488510
Source of Spectrum JX-2015-0-619
Synonyms 5-Hydroxy-7-isopropyl-4-methylbenzo[d][1,3]oxathiol-2-one 5-Hydroxy-4-methyl-7-(propan-2-yl)-1,3-benzoxathiol-2-one 5-Hydroxy-4-methyl-7-propan-2-yl-1,3-benzoxathiol-2-one 4-Methyl-5-oxidanyl-7-propan-2-yl-1,3-benzoxathiol-2-one
Wiley ID 1720538