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2-Thiophenecarboxylic acid, 5-(heptadecafluorooctyl)-3-hydroxy-, methyl ester
SpectraBase Compound ID BipppKIeLmO
InChI InChI=1S/C14H5F17O3S/c1-34-6(33)5-3(32)2-4(35-5)7(15,16)8(17,18)9(19,20)10(21,22)11(23,24)12(25,26)13(27,28)14(29,30)31/h2,32H,1H3
InChIKey HJUCGPFSPIGIEV-UHFFFAOYSA-N
Mol Weight 576.22 g/mol
Molecular Formula C14H5F17O3S
Exact Mass 575.968794 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DVEYXaeLH7Z
Name 2-Thiophenecarboxylic acid, 5-(heptadecafluorooctyl)-3-hydroxy-, methyl ester
Alternate Name(s) 2-Hydroxy-5-octylthiophenyl-4-ethylcarboxylate Methyl 5-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)-3-hydroxy-2-thiophenecarboxylate
CAS Registry Number 107112-35-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H5F17O3S
InChI InChI=1S/C14H5F17O3S/c1-34-6(33)5-3(32)2-4(35-5)7(15,16)8(17,18)9(19,20)10(21,22)11(23,24)12(25,26)13(27,28)14(29,30)31/h2,32H,1H3
InChIKey HJUCGPFSPIGIEV-UHFFFAOYSA-N
Molecular Weight 576.224 g/mol
SMILES Oc1cc(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)sc1C(=O)OC
SPLASH splash10-0007-0000090000-37ca4b55a465360f7668
Source of Spectrum F-42-667-8
Wiley ID 1408147