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3-(cyclohexylidenemethyl)benzo[b]thiophene
SpectraBase Compound ID 8EEfVwDOXlF
InChI InChI=1S/C15H16S/c1-2-6-12(7-3-1)10-13-11-16-15-9-5-4-8-14(13)15/h4-5,8-11H,1-3,6-7H2
InChIKey INPHKFOXARMNAR-UHFFFAOYSA-N
Mol Weight 228.35 g/mol
Molecular Formula C15H16S
Exact Mass 228.097272 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 20z5rRo4e0
Name 3-(cyclohexylidenemethyl)benzo[b]thiophene
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H16S
InChI InChI=1S/C15H16S/c1-2-6-12(7-3-1)10-13-11-16-15-9-5-4-8-14(13)15/h4-5,8-11H,1-3,6-7H2
InChIKey INPHKFOXARMNAR-UHFFFAOYSA-N
Instrument Name Agilent 7890A-5975C VL MSD
Ionization Type EI
Literature Reference DOI 10.1002/anie.202016268
Molecular Weight 228.353 g/mol
SMILES c1cc2c(cc1)scc2C=C1CCCCC1
SPLASH splash10-00a2-0920000000-31ba7fcc3488c73dbba2
Source of Spectrum ACI-60-SM19-2x
Wiley ID 1880263