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2-Methyl-3-(p-toluenesulfonyl)-2,5-bicyclo[2.2.2]octa-2,5-diene
SpectraBase Compound ID 4Cy8Vg0xeKu
InChI InChI=1S/C16H18O2S/c1-11-3-9-15(10-4-11)19(17,18)16-12(2)13-5-7-14(16)8-6-13/h3-5,7,9-10,13-14H,6,8H2,1-2H3/t13-,14+/m1/s1
InChIKey SAOMPMFYQBFWBZ-KGLIPLIRSA-N
Mol Weight 274.38 g/mol
Molecular Formula C16H18O2S
Exact Mass 274.102751 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8wnIESMOKos
Name 2-Methyl-3-(p-toluenesulfonyl)-2,5-bicyclo[2.2.2]octa-2,5-diene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18O2S
InChI InChI=1S/C16H18O2S/c1-11-3-9-15(10-4-11)19(17,18)16-12(2)13-5-7-14(16)8-6-13/h3-5,7,9-10,13-14H,6,8H2,1-2H3/t13-,14+/m1/s1
InChIKey SAOMPMFYQBFWBZ-KGLIPLIRSA-N
Molecular Weight 274.378 g/mol
SMILES C1(S(c2ccc(cc2)C)(=O)=O)=C([C@@]2(C=C[C@]1(CC2)[H])[H])C
SPLASH splash10-0007-9080000000-83e45e4b6ee9342d3dcd
Source of Spectrum J-64-7432-34
Wiley ID 1531203