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Spectral Data   Additional Data   Download  
Molecule
60007852
Chemical name(s)
Chemical formulaC15H8NO2SF17
Molecular weight589.269
Number of double bond equivalents (DBEs)4.0
Number of all rings, size of smallest set of smallest rings1, 1
Canonical name(s)
CAS-Number
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Molecule keywords
DOI
19F Spectrum
60008966 Rating: 10
Type19F
Measurement conditions
Temperature [K]298
SolventChloroform-D1 (CDCl3)
Field Strength [MHz]141.5094416011653
Assignment Method1H, H,H-COSY, H,H-NOESY, H,C-HMQC, H,C-HMBC, DEPTQ, 1H, 13C, 1H, H,H-COSY
Literature Gilles Arsenault; Brock Chittim; Jun Gu; Alan McAlees; Robert McCrindle; Valerie Robertson: Separation and fluorine nuclear magnetic resonance spectroscopic (19F NMR) analysis of individual branched isomers present in technical perfluorooctanesulfonic acid (PFOS), in: Chemosphere, vol. 73/2008, pp. 53 - 59 (DOI: 45-6535/$ - see front matter Ó 2008 El:10.1016/j.chemosphere.2007.06.096).
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