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(R)-[(E)-(3S,4R-5-Iodo-3,4-(isopropylidenedioxy)-1-pentenyl] p-tolyl sulfoxide
SpectraBase Compound ID I1eCLdym4Sc
InChI InChI=1S/C15H19IO3S/c1-11-4-6-12(7-5-11)20(17)9-8-13-14(10-16)19-15(2,3)18-13/h4-9,13-14H,10H2,1-3H3/b9-8+/t13-,14+,20?/m0/s1
InChIKey IFGQGXMOIGDIBA-PFCQAVANSA-N
Mol Weight 406.28 g/mol
Molecular Formula C15H19IO3S
Exact Mass 406.009961 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LsRZuOqonwG
Name (R)-[(E)-(3S,4R-5-Iodo-3,4-(isopropylidenedioxy)-1-pentenyl] p-tolyl sulfoxide
Comments Less than 3 mono-isotopic peaks
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Formula C15H19IO3S
InChI InChI=1S/C15H19IO3S/c1-11-4-6-12(7-5-11)20(17)9-8-13-14(10-16)19-15(2,3)18-13/h4-9,13-14H,10H2,1-3H3/b9-8+/t13-,14+,20?/m0/s1
InChIKey IFGQGXMOIGDIBA-PFCQAVANSA-N
Molecular Weight 406.278 g/mol
SMILES C1(O[C@](CI)([C@](\C=C\[S@+](c2ccc(cc2)C)[O-])(O1)[H])[H])(C)C
SPLASH splash10-000i-9000000000-7886c5c4101ccff07c3b
Source of Spectrum F-56-7943-63
Wiley ID 858710