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3H-2,1-Benzoxathiole, 3,3-dimethyl-, 1-oxide
SpectraBase Compound ID GeQOhrSHlnL
InChI InChI=1S/C9H10O2S/c1-9(2)7-5-3-4-6-8(7)12(10)11-9/h3-6H,1-2H3
InChIKey LDVVXOQGJPMSDF-UHFFFAOYSA-N
Mol Weight 182.24 g/mol
Molecular Formula C9H10O2S
Exact Mass 182.040151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID q6yhAnB9q4
Name 3H-2,1-Benzoxathiole, 3,3-dimethyl-, 1-oxide
Alternate Name(s) 3,3-Dimethyl-2,1-benzoxathiole 1-oxide 3,3-Dimethyl-3H-2,1-benzoxathiole 1-oxide
CAS Registry Number 66820-98-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H10O2S
InChI InChI=1S/C9H10O2S/c1-9(2)7-5-3-4-6-8(7)12(10)11-9/h3-6H,1-2H3
InChIKey LDVVXOQGJPMSDF-UHFFFAOYSA-N
Molecular Weight 182.237 g/mol
SMILES C1(OS(c2c1cccc2)=O)(C)C
SPLASH splash10-0gea-2900000000-45e998769daced4ee733
Source of Spectrum I-56-515-0
Wiley ID 1178124