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Sulfurous acid, hexyl nonyl ester
SpectraBase Compound ID LtzvJw8Pfz4
InChI InChI=1S/C15H32O3S/c1-3-5-7-9-10-11-13-15-18-19(16)17-14-12-8-6-4-2/h3-15H2,1-2H3
InChIKey DTTVLFXWXIHDTN-UHFFFAOYSA-N
Mol Weight 292.5 g/mol
Molecular Formula C15H32O3S
Exact Mass 292.207216 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C11HLMfsuzl
Name Sulfurous acid, hexyl nonyl ester
Comments Computed using HOSE algorithm
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Exact Mass 292.207216061 u
Formula C15H32O3S
InChI InChI=1S/C15H32O3S/c1-3-5-7-9-10-11-13-15-18-19(16)17-14-12-8-6-4-2/h3-15H2,1-2H3
InChIKey DTTVLFXWXIHDTN-UHFFFAOYSA-N
SMILES C(CCOS(OCCCCCCCCC)=O)CCC