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Tricyclo(4.1.1.0/2,5/)oct-7-yl-phenylsulfide

View entire compound with spectra: 1 NMR

Tricyclo(4.1.1.0/2,5/)oct-7-yl-phenylsulfide
SpectraBase Compound ID wBVBfIrBqy
InChI InChI=1S/C14H16S/c1-2-4-9(5-3-1)15-14-12-8-13(14)11-7-6-10(11)12/h1-5,10-14H,6-8H2/t10-,11+,12-,13-,14+/m0/s1
InChIKey AWUBLHFTOLLFIO-ZUWCUPBKSA-N
Mol Weight 216.34 g/mol
Molecular Formula C14H16S
Exact Mass 216.097272 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4CblMQKDaFw
Name Tricyclo(4.1.1.0/2,5/)oct-7-yl-phenylsulfide
CAS Registry Number 70938-91-9
Comments C-3,4 & C-8 = SYN
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C14H16S
InChI InChI=1S/C14H16S/c1-2-4-9(5-3-1)15-14-12-8-13(14)11-7-6-10(11)12/h1-5,10-14H,6-8H2/t10-,11+,12-,13-,14+/m0/s1
InChIKey AWUBLHFTOLLFIO-ZUWCUPBKSA-N
Instrument Name Bruker WH-90
Literature Reference M. Christl, R. Herbert, Chem. Ber. 112, 2022 (1979).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3