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3,4:8,9-DIBENZO-5,7-BIS-(TRIFLUOROMETHYL)-1-PHENYL-2,6,10,11-TETRAOXA-1-PHOSPHA-(5)-TRICYCLO-[5.3.1.0(1,5)]-UNDECANE
SpectraBase Compound ID 4C5wOqWUw1H
InChI InChI=1S/C22H13F6O4P/c23-21(24,25)19-15-10-4-6-12-17(15)29-33(32-19,14-8-2-1-3-9-14)20(31-19,22(26,27)28)16-11-5-7-13-18(16)30-33/h1-13H
InChIKey IAEMIKVWFBKOEI-UHFFFAOYSA-N
Mol Weight 486.31 g/mol
Molecular Formula C22H13F6O4P
Exact Mass 486.045565 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A4o9hncHTQB
Name 6H-6,13-Epoxy-11bH,13H-[1,2]benzoxaphospholo[2,3-b][1,4,2]benzodioxaphosphepin, 6-phenyl-11b,13-bis(trifluoromethyl)-
CAS Registry Number 81044-40-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H13F6O4P
InChI InChI=1S/C22H13F6O4P/c23-21(24,25)19-15-10-4-6-12-17(15)29-33(32-19,14-8-2-1-3-9-14)20(31-19,22(26,27)28)16-11-5-7-13-18(16)30-33/h1-13H
InChIKey IAEMIKVWFBKOEI-UHFFFAOYSA-N
Molecular Weight 486.306 g/mol
SMILES C12(P3(OC(O2)(C(F)(F)F)c2c(O3)cccc2)(Oc2ccccc12)c1ccccc1)C(F)(F)F
SPLASH splash10-01ti-7771900000-34260cefef30b2c75def
Source of Spectrum C-104-2500-0
Synonyms 1-Phenyl-9,11-bis(trifluoromethyl)-2,10,18,19-tetraoxa-1lambda(5)-phosphapentacyclo[9.7.1.0(1,9).0(3,8).0(12,17)]nonadeca-3,5,7,12,14,16-hexaene 3,4:8,9-dibenzo-5,7-bis(trifluoromethyl)-1-phenyl-2,6,10,11-tetraoxa-1-phospha(V)tricyclo[5.3.1.0]undecane
Wiley ID 1396388