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4-(Phenylthio)-3-decene
SpectraBase Compound ID 2Ea6D9VixF6
InChI InChI=1S/C16H24S/c1-3-5-6-8-12-15(11-4-2)17-16-13-9-7-10-14-16/h7,9-11,13-14H,3-6,8,12H2,1-2H3/b15-11+
InChIKey CAWPNAMSMVFUFD-RVDMUPIBSA-N
Mol Weight 248.43 g/mol
Molecular Formula C16H24S
Exact Mass 248.159872 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4VnQkpTP6D9
Name 4-(Phenylthio)-3-decene
Comments Computed using HOSE algorithm
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Exact Mass 248.159871947 u
Formula C16H24S
InChI InChI=1S/C16H24S/c1-3-5-6-8-12-15(11-4-2)17-16-13-9-7-10-14-16/h7,9-11,13-14H,3-6,8,12H2,1-2H3/b15-11+
InChIKey CAWPNAMSMVFUFD-RVDMUPIBSA-N
Molecular Weight 248.428 g/mol
SMILES C(\C=C/(SC=1C=CC=CC1)CCCCCC)C