Bisperfluorooctyl phosphate

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Systematic / IUPAC Name: Bis(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl) hydrogen phosphate

ID: Reference6651

Other Names: Bis(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluoro-1-octanol) hydrogen phosphate;
Bis[2-(perfluorohexyl)ethyl] phosphate

Formula: C16H9F26O4P

Spectral Data

Bisperfluorooctyl phosphate mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments LTQ Orbitrap XL
No. of Spectral Trees 1
No. of Spectra 29
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 7/26/2017 8:38:06 AM
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Identificators

InChI InChI=1S/C16H9F26O4P/c17-5(18,7(21,22)9(25,26)11(29,30)13(33,34)15(37,38)39)1-3-45-47(43,44)46-4-2-6(19,20)8(23,24)10(27,28)12(31,32)14(35,36)16(40,41)42/h1-4H2,(H,43,44)
InChI Key ZDYYWMSLMLTXDM-UHFFFAOYSA-N
Canonical SMILES C(COP(=O)(O)OCCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
CAS
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Other Names Bis(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluoro-1-octanol) hydrogen phosphate;
Bis[2-(perfluorohexyl)ethyl] phosphate

In Other Databases

ChemSpider 31045606
ChEBI CHEBI:83539
PubChem 14550408