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Tricyclo[10.2.2.2(5,8)]octadeca-5,7,12,14,15,17-hexaene, 3-(phenylsulfinyl)-10-(phenylsulfonyl)-, stereoisomer
SpectraBase Compound ID LDAS9twgl2X
InChI InChI=1S/C30H28O3S2/c31-34(27-7-3-1-4-8-27)28-19-23-11-15-25(16-12-23)21-30(22-26-17-13-24(20-28)14-18-26)35(32,33)29-9-5-2-6-10-29/h1-18,28,30H,19-22H2
InChIKey HVHMPCTUCKHFTB-UHFFFAOYSA-N
Mol Weight 500.67 g/mol
Molecular Formula C30H28O3S2
Exact Mass 500.147987 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C8bort6pRK9
Name Tricyclo[10.2.2.2(5,8)]octadeca-5,7,12,14,15,17-hexaene, 3-(phenylsulfinyl)-10-(phenylsulfonyl)-, stereoisomer
CAS Registry Number 69577-23-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H28O3S2
InChI InChI=1S/C30H28O3S2/c31-34(27-7-3-1-4-8-27)28-19-23-11-15-25(16-12-23)21-30(22-26-17-13-24(20-28)14-18-26)35(32,33)29-9-5-2-6-10-29/h1-18,28,30H,19-22H2
InChIKey HVHMPCTUCKHFTB-UHFFFAOYSA-N
Molecular Weight 500.671 g/mol
SMILES C1(S(=O)(=O)c2ccccc2)Cc2ccc(CC(S(=O)c3ccccc3)Cc3ccc(C1)cc3)cc2
SPLASH splash10-001i-0094000000-23b9accb6ac45a52d088
Source of Spectrum K-112-256-4
Synonyms 2,11-bis(phenylthio)[3.3]paracyclophan-s,S,s'-trioxide 3-(Phenylsulfinyl)-10-(phenylsulfonyl)tricyclo[10.2.2.2(5,8)]octadeca-1(14),5,7,12,15,17-hexaene phenyl 10-(phenylsulfinyl)tricyclo[10.2.2.2(5,8)]octadeca-1(14),5,7,12,15,17-hexaen-3-yl sulfone
Wiley ID 1398909