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3,7-bis(chloranyl)-11-(2,4-ditert-butylphenoxy)-11-sulfanylidene-5-(trichloromethyl)-5H-benzo[d][1,3,2]benzodioxaphosphocine

View entire compound with spectra: 1 MS (GC)

3,7-bis(chloranyl)-11-(2,4-ditert-butylphenoxy)-11-sulfanylidene-5-(trichloromethyl)-5H-benzo[d][1,3,2]benzodioxaphosphocine
SpectraBase Compound ID AuxgNHcW1gk
InChI InChI=1S/C28H28Cl5O3PS/c1-26(2,3)16-7-10-24(21(13-16)27(4,5)6)36-37(38)34-22-11-8-17(29)14-19(22)25(28(31,32)33)20-15-18(30)9-12-23(20)35-37/h7-15,25H,1-6H3
InChIKey XNJUBLFXYSKVEU-UHFFFAOYSA-N
Mol Weight 652.8 g/mol
Molecular Formula C28H28Cl5O3PS
Exact Mass 649.993941 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 30x5YQBfMVp
Name 3,7-bis(chloranyl)-11-(2,4-ditert-butylphenoxy)-11-sulfanylidene-5-(trichloromethyl)-5H-benzo[d][1,3,2]benzodioxaphosphocine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H28Cl5O3PS
InChI InChI=1S/C28H28Cl5O3PS/c1-26(2,3)16-7-10-24(21(13-16)27(4,5)6)36-37(38)34-22-11-8-17(29)14-19(22)25(28(31,32)33)20-15-18(30)9-12-23(20)35-37/h7-15,25H,1-6H3
InChIKey XNJUBLFXYSKVEU-UHFFFAOYSA-N
Molecular Weight 652.828 g/mol
SMILES c12OP(Oc3c(C(c2cc(cc1)Cl)C(Cl)(Cl)Cl)cc(cc3)Cl)(Oc1c(cc(cc1)C(C)(C)C)C(C)(C)C)=S
SPLASH splash10-01pa-9130040000-9f299b2e019fed678c29
Source of Spectrum Y1-42-2592-4
Synonyms 3,7-Dichloro-11-(2,4-ditert-butylphenoxy)-11-sulfanylidene-5-(trichloromethyl)-5H-benzo[d][1,3,2]benzodioxaphosphocin 3,7-Dichloro-11-(2,4-ditert-butylphenoxy)-11-sulfanylidene-5-(trichloromethyl)-5H-benzo[d][1,3,2]benzodioxaphosphocine 3,7-Dichloro-11-(2,4-ditert-butylphenoxy)-11-thioxo-5-(trichloromethyl)-5H-benzo[d][1,3,2]benzodioxaphosphocin 3,7-Dichloro-11-(2,4-ditert-butylphenoxy)-11-thioxo-5-(trichloromethyl)-5H-benzo[d][1,3,2]benzodioxaphosphocine
Wiley ID 1565359