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(3-Allylbicyclo[1.1.1]pentan-1-yl)(phenyl)sulfane
SpectraBase Compound ID 5FRBhOLNZww
InChI InChI=1S/C14H16S/c1-2-8-13-9-14(10-13,11-13)15-12-6-4-3-5-7-12/h2-7H,1,8-11H2
InChIKey KNXALZFFHHBESL-UHFFFAOYSA-N
Mol Weight 216.34 g/mol
Molecular Formula C14H16S
Exact Mass 216.097272 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2r38afnLfOW
Name (3-Allylbicyclo[1.1.1]pentan-1-yl)(phenyl)sulfane
Appearance Colorless liquid
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Formula C14H16S
InChI InChI=1S/C14H16S/c1-2-8-13-9-14(10-13,11-13)15-12-6-4-3-5-7-12/h2-7H,1,8-11H2
InChIKey KNXALZFFHHBESL-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95Q or Finnigan MAT 90
Ionization Type EI
Literature Reference DOI 10.1002/anie.202009340
Molecular Weight 216.342 g/mol
Reported Formula C14H16S
SMILES c1c(cccc1)SC12CC(C2)(C1)CC=C
SPLASH splash10-06vu-9800000000-22bdc496d40188f88342
Source of Spectrum ACI-59-SM18-9f
Wiley ID 1858382