6-Fluoro-8-[(methylsulfonyl)methyl]-4H-1,3-benzodioxine

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Systematic / IUPAC Name: 6-Fluoro-8-[(methylsulfonyl)methyl]-4H-1,3-benzodioxine

ID: Reference3640

Other Names:

Formula: C10H11FO4S

Spectral Data

6-Fluoro-8-[(methylsulfonyl)methyl]-4H-1,3-benzodioxine mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 1
No. of Spectra 45
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 1/26/2016 12:06:56 PM
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Identificators

InChI InChI=1S/C10H11FO4S/c1-16(12,13)5-8-3-9(11)2-7-4-14-6-15-10(7)8/h2-3H,4-6H2,1H3
InChI Key OIPNTWFUNWPPTA-UHFFFAOYSA-N
Canonical SMILES CS(=O)(=O)CC1=C2C(=CC(=C1)F)COCO2
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Other Names

In Other Databases

ChemSpider 509640
PubChem 586306