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Spiro[3H-2-benzothiopyran-3,2'-[2H]pyran], dodecahydro-, (3.alpha.,4a.beta.,8a.alpha.)-
SpectraBase Compound ID LCm5xEhXR7P
InChI InChI=1S/C13H22OS/c1-2-6-12-10-15-13(9-11(12)5-1)7-3-4-8-14-13/h11-12H,1-10H2/t11-,12+,13-/m0/s1
InChIKey DROBCNONARKUSD-XQQFMLRXSA-N
Mol Weight 226.38 g/mol
Molecular Formula C13H22OS
Exact Mass 226.139137 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1pesuYwOe3V
Name Spiro[3H-2-benzothiopyran-3,2'-[2H]pyran], dodecahydro-, (3.alpha.,4a.beta.,8a.alpha.)-
CAS Registry Number 78419-24-6
Comments Less than 3 mono-isotopic peaks
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Formula C13H22OS
InChI InChI=1S/C13H22OS/c1-2-6-12-10-15-13(9-11(12)5-1)7-3-4-8-14-13/h11-12H,1-10H2/t11-,12+,13-/m0/s1
InChIKey DROBCNONARKUSD-XQQFMLRXSA-N
Molecular Weight 226.378 g/mol
SMILES [C@@]12(SC[C@@]3([C@](C2)(CCCC3)[H])[H])OCCCC1
SPLASH splash10-003r-0090000000-2a2a129a345f4afe27af
Source of Spectrum I-59-1130-0
Synonyms (3S,4aS,8aS)-octahydrospiro[2-benzothiopyran-3,2'-oxane] 2-Thiabicyclo[4.4.0]decanespiro(2-ocacyclohexane0
Wiley ID 1227527