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syn-2,3-Dithia-9-[(n-hexanoyl)oxy]bicyclo[4.2.1]nonane S-oxide
SpectraBase Compound ID Hze55fCxJgY
InChI InChI=1S/C13H22O3S2/c1-2-3-4-9-12(14)16-13-10-7-5-6-8-11(13)18(15)17-10/h10-11,13H,2-9H2,1H3/t10-,11-,13?,18?/m1/s1
InChIKey JQWVDOKMFRKCCE-UZTXTECDSA-N
Mol Weight 290.44 g/mol
Molecular Formula C13H22O3S2
Exact Mass 290.101037 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CX5eQHQTPnI
Name syn-2,3-Dithia-9-[(n-hexanoyl)oxy]bicyclo[4.2.1]nonane S-oxide
Comments Less than 3 mono-isotopic peaks
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Formula C13H22O3S2
InChI InChI=1S/C13H22O3S2/c1-2-3-4-9-12(14)16-13-10-7-5-6-8-11(13)18(15)17-10/h10-11,13H,2-9H2,1H3/t10-,11-,13?,18?/m1/s1
InChIKey JQWVDOKMFRKCCE-UZTXTECDSA-N
Molecular Weight 290.436 g/mol
SMILES [C@]12([S@](S[C@@](C2OC(=O)CCCCC)(CCCC1)[H])=O)[H]
SPLASH splash10-0002-9010000000-2ddfd48a44572a1bab5c
Source of Spectrum C-115-3070-10
Synonyms 7-oxido-7,8-dithiabicyclo[4.2.1]non-9-yl hexanoate
Wiley ID 1293259