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2-Iodo-3-perfluorohexylpropanoic acid

View entire compound with spectra: 1 MS (GC)

2-Iodo-3-perfluorohexylpropanoic acid
SpectraBase Compound ID 1VgzoMUMol6
InChI InChI=1S/C9H4F13IO2/c10-4(11,1-2(23)3(24)25)5(12,13)6(14,15)7(16,17)8(18,19)9(20,21)22/h2H,1H2,(H,24,25)
InChIKey NPPSLFJBIKCAFD-UHFFFAOYSA-N
Mol Weight 518.01 g/mol
Molecular Formula C9H4F13IO2
Exact Mass 517.90484 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KZKV54nWKuq
Name 2-Iodo-3-perfluorohexylpropanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H4F13IO2
InChI InChI=1S/C9H4F13IO2/c10-4(11,1-2(23)3(24)25)5(12,13)6(14,15)7(16,17)8(18,19)9(20,21)22/h2H,1H2,(H,24,25)
InChIKey NPPSLFJBIKCAFD-UHFFFAOYSA-N
Molecular Weight 518.013 g/mol
SMILES OC(C(CC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)I)=O
SPLASH splash10-014i-5009080000-677adcfb68d939b914f9
Source of Spectrum F-68-6859-2e
Wiley ID 1717506