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cis-Bicyclo[2.1.1]hexa-2,3-diyl bis(p-toluenesulfonate)
SpectraBase Compound ID EBx9hZYvLf2
InChI InChI=1S/C20H22O6S2/c1-13-3-7-17(8-4-13)27(21,22)25-19-15-11-16(12-15)20(19)26-28(23,24)18-9-5-14(2)6-10-18/h3-10,15-16,19-20H,11-12H2,1-2H3/t15-,16+,19?,20?
InChIKey PXHIOHRORMTIEZ-BANKROOTSA-N
Mol Weight 422.51 g/mol
Molecular Formula C20H22O6S2
Exact Mass 422.085781 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GIvTHQMoRYU
Name cis-Bicyclo[2.1.1]hexa-2,3-diyl bis(p-toluenesulfonate)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22O6S2
InChI InChI=1S/C20H22O6S2/c1-13-3-7-17(8-4-13)27(21,22)25-19-15-11-16(12-15)20(19)26-28(23,24)18-9-5-14(2)6-10-18/h3-10,15-16,19-20H,11-12H2,1-2H3/t15-,16+,19?,20?
InChIKey PXHIOHRORMTIEZ-BANKROOTSA-N
Molecular Weight 422.510 g/mol
SMILES C1(OS(c2ccc(cc2)C)(=O)=O)C(OS(c2ccc(cc2)C)(=O)=O)[C@]2([H])C[C@]1(C2)[H]
SPLASH splash10-0a4l-8900000000-0551c7191799d39a8800
Source of Spectrum K-126-1757-27
Synonyms 3-{[(4-methylphenyl)sulfonyl]oxy}bicyclo[2.1.1]hex-2-yl 4-methylbenzenesulfonate
Wiley ID 1378484