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Phenoxathiin, 10-oxide

View entire compound with spectra: 9 NMR, 2 FTIR, and 3 MS (GC)

Phenoxathiin, 10-oxide
SpectraBase Compound ID LPDmeRyHg1S
InChI InChI=1S/C12H8O2S/c13-15-11-7-3-1-5-9(11)14-10-6-2-4-8-12(10)15/h1-8H
InChIKey ZESLIAUQVGLCIA-UHFFFAOYSA-N
Mol Weight 216.25 g/mol
Molecular Formula C12H8O2S
Exact Mass 216.024501 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7ysKOekwXMg
Name Phenoxathiin, 10-oxide
Alternate Name(s) Phenoxathiin S-oxide Phenoxathiin sulfoxide phenoxathiine 10-oxide AI3-17429 BRN 0152292 NSC 3222
CAS Registry Number 948-44-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H8O2S
InChI InChI=1S/C12H8O2S/c13-15-11-7-3-1-5-9(11)14-10-6-2-4-8-12(10)15/h1-8H
InChIKey ZESLIAUQVGLCIA-UHFFFAOYSA-N
Molecular Weight 216.254 g/mol
SMILES c12S(=O)c3c(Oc2cccc1)cccc3
SPLASH splash10-0gb9-0790000000-c5914ac24a77123c09ce
Source of Spectrum AJ-57-2526-2
Wiley ID 1215434