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4-Benzylsulfanyl[2.2]paracyclophane

View entire compound with spectra: 1 MS (GC)

4-Benzylsulfanyl[2.2]paracyclophane
SpectraBase Compound ID 364sCBHX8wy
InChI InChI=1S/C23H22S/c1-2-4-21(5-3-1)17-24-23-16-20-11-10-18-6-8-19(9-7-18)12-14-22(23)15-13-20/h1-9,13,15-16H,10-12,14,17H2
InChIKey YCLIBBJSDMWISG-UHFFFAOYSA-N
Mol Weight 330.49 g/mol
Molecular Formula C23H22S
Exact Mass 330.144222 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7X4ITEOIt2Q
Name 4-Benzylsulfanyl[2.2]paracyclophane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H22S
InChI InChI=1S/C23H22S/c1-2-4-21(5-3-1)17-24-23-16-20-11-10-18-6-8-19(9-7-18)12-14-22(23)15-13-20/h1-9,13,15-16H,10-12,14,17H2
InChIKey YCLIBBJSDMWISG-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol800161m
Molecular Weight 330.489 g/mol
SMILES c1c2CCc3cc(SCc4ccccc4)c(CCc(cc2)c1)cc3
SPLASH splash10-001l-4319000000-20d44d5120f632377dd5
Source of Spectrum A1-10-1271/SMS5-3a
Wiley ID 1759283