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7-(Pent-4-en-1-yl)-1,4-dithiaspiro[4.5]dec-6-ene
SpectraBase Compound ID 7UGHV1ITXyC
InChI InChI=1S/C13H20S2/c1-2-3-4-6-12-7-5-8-13(11-12)14-9-10-15-13/h2,11H,1,3-10H2
InChIKey CDHQILBPCRWGPT-UHFFFAOYSA-N
Mol Weight 240.42 g/mol
Molecular Formula C13H20S2
Exact Mass 240.100643 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2PwZG47LwoA
Name 7-(Pent-4-en-1-yl)-1,4-dithiaspiro[4.5]dec-6-ene
Appearance Colorless oil
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Formula C13H20S2
InChI InChI=1S/C13H20S2/c1-2-3-4-6-12-7-5-8-13(11-12)14-9-10-15-13/h2,11H,1,3-10H2
InChIKey CDHQILBPCRWGPT-UHFFFAOYSA-N
Instrument Name Agilent MS5977A MSD-Agilent 7890 B
Ionization Type EI
Literature Reference DOI 10.1002/anie.201700837
Molecular Weight 240.423 g/mol
Quality 301
Reported Formula C13H20(32)S2
SMILES C(CCC=C)C1=CC2(SCCS2)CCC1
SPLASH splash10-01tc-2960000000-7e17421d65d13b2a65dc
Source of Spectrum ACI-56-SM36-25 (DOI: 10.1002/anie.201700837)
Thin-Layer Chromatography 0.21 (P/Et2O, 99:1) [KMnO4]
Wiley ID 1895692