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2-(2,2,3,3,4,4,4-heptafluorobutyl)-4-iodo-glutaric acid diethyl ester
SpectraBase Compound ID 4CyI3KCBVlV
InChI InChI=1S/C13H16F7IO4/c1-3-24-9(22)7(5-8(21)10(23)25-4-2)6-11(14,15)12(16,17)13(18,19)20/h7-8H,3-6H2,1-2H3
InChIKey KUTKRTBTVKJGEJ-UHFFFAOYSA-N
Mol Weight 496.16 g/mol
Molecular Formula C13H16F7IO4
Exact Mass 495.998151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 55Hnolm4Wl2
Name 2-(2,2,3,3,4,4,4-heptafluorobutyl)-4-iodo-glutaric acid diethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16F7IO4
InChI InChI=1S/C13H16F7IO4/c1-3-24-9(22)7(5-8(21)10(23)25-4-2)6-11(14,15)12(16,17)13(18,19)20/h7-8H,3-6H2,1-2H3
InChIKey KUTKRTBTVKJGEJ-UHFFFAOYSA-N
Molecular Weight 496.160 g/mol
SMILES C(C(CC(C(=O)OCC)CC(C(=O)OCC)I)(F)F)(C(F)(F)F)(F)F
SPLASH splash10-066r-9083300000-b94cf578d05c2e8f170e
Source of Spectrum J-60-3469-5
Synonyms 2-(2,2,3,3,4,4,4-heptafluorobutyl)-4-iodopentanedioic acid diethyl ester Diethyl 2-(2,2,3,3,4,4,4-heptafluorobutyl)-4-iodo-pentanedioate Diethyl 2-[2,2,3,3,4,4,4-heptakis(fluoranyl)butyl]-4-iodanyl-pentanedioate
Wiley ID 1398133