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4-(p-Toluenesulfonyl)[2.2]paracyclophane

View entire compound with spectra: 1 MS (GC)

4-(p-Toluenesulfonyl)[2.2]paracyclophane
SpectraBase Compound ID D3vtYV1ULC5
InChI InChI=1S/C23H22O2S/c1-17-2-14-22(15-3-17)26(24,25)23-16-20-9-8-18-4-6-19(7-5-18)10-12-21(23)13-11-20/h2-7,11,13-16H,8-10,12H2,1H3
InChIKey IDRBUQGXMIKMOG-UHFFFAOYSA-N
Mol Weight 362.49 g/mol
Molecular Formula C23H22O2S
Exact Mass 362.134051 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3gXcLaVgqHh
Name 4-(p-Toluenesulfonyl)[2.2]paracyclophane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H22O2S
InChI InChI=1S/C23H22O2S/c1-17-2-14-22(15-3-17)26(24,25)23-16-20-9-8-18-4-6-19(7-5-18)10-12-21(23)13-11-20/h2-7,11,13-16H,8-10,12H2,1H3
InChIKey IDRBUQGXMIKMOG-UHFFFAOYSA-N
Molecular Weight 362.487 g/mol
SMILES c1(S(c2ccc(cc2)C)(=O)=O)c2ccc(c1)CCc1ccc(CC2)cc1
SPLASH splash10-0w2c-0903000000-c4bd0e9d0dbb2a11623f
Source of Spectrum J-56-5678-19
Synonyms 4-Methylphenyl tricyclo[8.2.2.2(4,7)]hexadeca-1(12),4,6,10,13,15-hexaen-5-yl sulfone 5-[(4-methylphenyl)sulfonyl]tricyclo[8.2.2.2(4,7)]hexadeca-1(12),4,6,10,13,15-hexaene
Wiley ID 1349917