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2-ACETYL-2-METHYL-4H-3,1-BENZOXATHIINE
SpectraBase Compound ID 49Ui0mGQcsT
InChI InChI=1S/C11H12O2S/c1-8(12)11(2)13-7-9-5-3-4-6-10(9)14-11/h3-6H,7H2,1-2H3
InChIKey MSQYMRHOYVCCHS-UHFFFAOYSA-N
Mol Weight 208.27 g/mol
Molecular Formula C11H12O2S
Exact Mass 208.055801 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AtT64zexy1Z
Name 2-Acetyl-2-metyl-4H-3,1-benzoxathiine
CAS Registry Number 124921-62-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12O2S
InChI InChI=1S/C11H12O2S/c1-8(12)11(2)13-7-9-5-3-4-6-10(9)14-11/h3-6H,7H2,1-2H3
InChIKey MSQYMRHOYVCCHS-UHFFFAOYSA-N
Molecular Weight 208.275 g/mol
SMILES C1(Sc2ccccc2CO1)(C(=O)C)C
SPLASH splash10-00r6-6900000000-d9807b4b77443ae4a0a8
Source of Spectrum K-123-1146-4
Synonyms 1-(2-Methyl-4H-3,1-benzoxathiin-2-yl)ethanone
Wiley ID 1206488