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(4aR,8aR)-8-(Hex-4-yn-1-yl)-1,5-dithiaspiro[5.5]undec-7-ene
SpectraBase Compound ID EHJlmuj9RCW
InChI InChI=1S/C15H22S2/c1-11-12-5-2-6-14(12)7-3-8-15(13(11)14)16-9-4-10-17-15/h13H,2-10H2,1H3/t13-,14+/m1/s1
InChIKey GOWYQUOXNNBTBP-KGLIPLIRSA-N
Mol Weight 266.46 g/mol
Molecular Formula C15H22S2
Exact Mass 266.116293 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C1AfqGUv0lg
Name (4aR,8aR)-8-(Hex-4-yn-1-yl)-1,5-dithiaspiro[5.5]undec-7-ene
Appearance Colorless oil
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Exact Mass 266.116293056 u
Formula C15H22S2
InChI InChI=1S/C15H22S2/c1-11-12-5-2-6-14(12)7-3-8-15(13(11)14)16-9-4-10-17-15/h13H,2-10H2,1H3/t13-,14+/m1/s1
InChIKey GOWYQUOXNNBTBP-KGLIPLIRSA-N
Instrument Name Agilent MS5977A MSD-Agilent 7890 B
Ionization Type EI
Literature Reference DOI 10.1002/anie.201700837
Molecular Weight 266.461 g/mol
Quality 267
Reported Formula C15H22(32)S2
SMILES C1CCSC2(S1)[C@]1([C@@]3(CCC2)C(=C1C)CCC3)[H]
SPLASH splash10-014i-1590000000-74c71272eda48dcbf14f
Source of Spectrum ACI-56-SM41-2d (DOI: 10.1002/anie.201700837)
Thin-Layer Chromatography 0.38 (P/Et2O, 99:1) [KMnO4]
Wiley ID 1895696