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8-(Pent-4-en-1-yl)-1,5-dithiaspiro[5.5]undec-7-ene
SpectraBase Compound ID Aqhu80WbGL3
InChI InChI=1S/C14H22S2/c1-2-3-4-7-13-8-5-9-14(12-13)15-10-6-11-16-14/h2,12H,1,3-11H2
InChIKey XIKMWHCFOLJOJX-UHFFFAOYSA-N
Mol Weight 254.45 g/mol
Molecular Formula C14H22S2
Exact Mass 254.116293 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9VYfcHkIWws
Name 8-(Pent-4-en-1-yl)-1,5-dithiaspiro[5.5]undec-7-ene
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 254.116293056 u
Formula C14H22S2
InChI InChI=1S/C14H22S2/c1-2-3-4-7-13-8-5-9-14(12-13)15-10-6-11-16-14/h2,12H,1,3-11H2
InChIKey XIKMWHCFOLJOJX-UHFFFAOYSA-N
Instrument Name Agilent MS5977A MSD-Agilent 7890 B
Ionization Type EI
Literature Reference DOI 10.1002/anie.201700837
Molecular Weight 254.450 g/mol
Quality 222
Reported Formula C14H22(32)S2
SMILES C(CCC=C)C1=CC2(SCCCS2)CCC1
SPLASH splash10-0udi-9660000000-70e42262f4eb0afade3e
Source of Spectrum ACI-56-SM8-1a (DOI: 10.1002/anie.201700837)
Thin-Layer Chromatography 0.21 (P/Et2O, 99.5:0.5) [KMnO4]
Wiley ID 1895681