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trans-11,12-Di(phentlsulfonyl)tetracyclo[6.2.2.2(3,6).0(2,7)]tetradeca-9,13-dien-4-.beta.-ol
SpectraBase Compound ID 8MAnNHmaq5E
InChI InChI=1S/C26H26O5S2/c27-22-15-16-11-12-19(22)24-21-14-13-20(23(16)24)25(32(28,29)17-7-3-1-4-8-17)26(21)33(30,31)18-9-5-2-6-10-18/h1-14,16,19-27H,15H2
InChIKey PJCMMCXINYZHDD-UHFFFAOYSA-N
Mol Weight 482.61 g/mol
Molecular Formula C26H26O5S2
Exact Mass 482.122166 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KC94KRZSLpt
Name trans-11,12-Di(phentlsulfonyl)tetracyclo[6.2.2.2(3,6).0(2,7)]tetradeca-9,13-dien-4-.beta.-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H26O5S2
InChI InChI=1S/C26H26O5S2/c27-22-15-16-11-12-19(22)24-21-14-13-20(23(16)24)25(32(28,29)17-7-3-1-4-8-17)26(21)33(30,31)18-9-5-2-6-10-18/h1-14,16,19-27H,15H2
InChIKey PJCMMCXINYZHDD-UHFFFAOYSA-N
Molecular Weight 482.609 g/mol
SMILES OC1CC2C3C4C(C(S(=O)(=O)c5ccccc5)C(C=C4)C3C1C=C2)S(=O)(=O)c1ccccc1
SPLASH splash10-002f-5907000000-5d7e984fcb374deed913
Source of Spectrum QA-40-165-16
Wiley ID 861543