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2-[2(E)-penten-1-yl]-3-phenylthiirane
SpectraBase Compound ID Ke7DA1Gp7ok
InChI InChI=1S/C13H16S/c1-2-3-5-10-12-13(14-12)11-8-6-4-7-9-11/h3-9,12-13H,2,10H2,1H3/b5-3+
InChIKey SMWRRPAAAKPOJG-HWKANZROSA-N
Mol Weight 204.33 g/mol
Molecular Formula C13H16S
Exact Mass 204.097272 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2fEhsX3FXeC
Name 2-[2(E)-penten-1-yl]-3-phenylthiirane
Alternate Name(s) 2-[(2E)-2-pentenyl]-3-phenylthiirane
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Formula C13H16S
InChI InChI=1S/C13H16S/c1-2-3-5-10-12-13(14-12)11-8-6-4-7-9-11/h3-9,12-13H,2,10H2,1H3/b5-3+
InChIKey SMWRRPAAAKPOJG-HWKANZROSA-N
Molecular Weight 204.331 g/mol
SMILES C1(SC1C\C=C\CC)c1ccccc1
SPLASH splash10-004l-4900000000-7e0d145433cdb0a22a41
Source of Spectrum F-52-2164-4
Wiley ID 795130