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9-Pefluorobutyl-octadecanoic acid
SpectraBase Compound ID E3DsIWXvxFN
InChI InChI=1S/C22H35F9O2/c1-2-3-4-5-6-8-11-14-17(15-12-9-7-10-13-16-18(32)33)19(23,24)20(25,26)21(27,28)22(29,30)31/h17H,2-16H2,1H3,(H,32,33)
InChIKey NQLYAXWLTGWRPP-UHFFFAOYSA-N
Mol Weight 502.5 g/mol
Molecular Formula C22H35F9O2
Exact Mass 502.249334 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8vV0ehPiQqP
Name 9-Pefluorobutyl-octadecanoic acid
CAS Registry Number 138697-17-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H35F9O2
InChI InChI=1S/C22H35F9O2/c1-2-3-4-5-6-8-11-14-17(15-12-9-7-10-13-16-18(32)33)19(23,24)20(25,26)21(27,28)22(29,30)31/h17H,2-16H2,1H3,(H,32,33)
InChIKey NQLYAXWLTGWRPP-UHFFFAOYSA-N
Molecular Weight 502.506 g/mol
SMILES OC(CCCCCCCC(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)CCCCCCCCC)=O
SPLASH splash10-03k9-9000000000-3641b35ecc14c8f706cb
Source of Spectrum U-1992-214-11
Synonyms 9-(1,1,2,2,3,3,4,4,4-nonafluorobutyl)octadecanoic acid
Wiley ID 763731