8-Chloroperfluorooctylphosphonic acid

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Systematic / IUPAC Name: (8-Chloro-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-hexadecafluorooctyl)phosphonic acid

ID: Reference13252

Other Names: AA-1645

Formula: C8H2ClF16O3P

Class: Perfluorinated Hydrocarbons

Spectral Data

8-Chloroperfluorooctylphosphonic acid 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 Orbitrap ID-X with ETD_Cal Gateshead
No. of Spectral Trees 1
No. of Spectra 105
Tandem Spectra MS1, MS2
Ionization Methods NSI
Analyzers FT
Last Modification 8/9/2024 8:22:01 AM
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Identificators

InChI InChI=1S/C8H2ClF16O3P/c9-7(22,23)5(18,19)3(14,15)1(10,11)2(12,13)4(16,17)6(20,21)8(24,25)29(26,27)28/h(H2,26,27,28)
InChI Key JTUDXWNBUPNSAX-UHFFFAOYSA-N
Canonical SMILES C(C(C(C(C(F)(F)Cl)(F)F)(F)F)(F)F)(C(C(C(F)(F)P(=O)(O)O)(F)F)(F)F)(F)F
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Other Names AA-1645

In Other Databases

ChemSpider 95622309
PubChem 138395139