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(R)-5,6-Benzo-4',5',6'-trimethyl-2,2'-biphenol Bis-triflate

View entire compound with spectra: 1 MS (GC)

(R)-5,6-Benzo-4',5',6'-trimethyl-2,2'-biphenol Bis-triflate
SpectraBase Compound ID LOZEVyzEV4M
InChI InChI=1S/C21H16F6O6S2/c1-11-10-17(33-35(30,31)21(25,26)27)18(13(3)12(11)2)19-15-7-5-4-6-14(15)8-9-16(19)32-34(28,29)20(22,23)24/h4-10H,1-3H3
InChIKey RLIRJPGYCGOSQA-UHFFFAOYSA-N
Mol Weight 542.46 g/mol
Molecular Formula C21H16F6O6S2
Exact Mass 542.02925 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4pzOkf2QZ5S
Name (R)-5,6-Benzo-4',5',6'-trimethyl-2,2'-biphenol Bis-triflate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H16F6O6S2
InChI InChI=1S/C21H16F6O6S2/c1-11-10-17(33-35(30,31)21(25,26)27)18(13(3)12(11)2)19-15-7-5-4-6-14(15)8-9-16(19)32-34(28,29)20(22,23)24/h4-10H,1-3H3
InChIKey RLIRJPGYCGOSQA-UHFFFAOYSA-N
Molecular Weight 542.463 g/mol
SMILES C(S(Oc1c(-c2c(c(C)c(cc2OS(C(F)(F)F)(=O)=O)C)C)c2ccccc2cc1)(=O)=O)(F)(F)F
SPLASH splash10-02t9-9080020000-efb133fff6a555297e09
Source of Spectrum KD-15-2259-4
Wiley ID 1637096