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7-(isopropylthio)bicyclo[4.4.1]undeca-1,3,5,7,9-pentaene
SpectraBase Compound ID BtOVT18crkx
InChI InChI=1S/C14H16S/c1-11(2)15-14-9-5-7-12-6-3-4-8-13(14)10-12/h3-9,11H,10H2,1-2H3
InChIKey WTBWDLZUZRFBES-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 ITeGXE9pHqk
Name 7-(isopropylthio)bicyclo[4.4.1]undeca-1,3,5,7,9-pentaene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16S
InChI InChI=1S/C14H16S/c1-11(2)15-14-9-5-7-12-6-3-4-8-13(14)10-12/h3-9,11H,10H2,1-2H3
InChIKey WTBWDLZUZRFBES-UHFFFAOYSA-N
Molecular Weight 216.342 g/mol
SMILES C1(=C2CC(C=CC=C2)=CC=C1)SC(C)C
SPLASH splash10-00dl-0910000000-1d41203f3cc8eca07997
Source of Spectrum H-80-135-3
Synonyms 7-(propan-2-ylthio)bicyclo[4.4.1]undeca-1,3,5,7,9-pentaene 7-isopropylsulfanylbicyclo[4.4.1]undeca-1,3,5,7,9-pentaene 7-Propan-2-ylsulfanylbicyclo[4.4.1]undeca-1,3,5,7,9-pentaene
Wiley ID 1215958