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Trifluoroacetic acid, 4-methylpentyl ester
SpectraBase Compound ID IdxEdEKFomU
InChI InChI=1S/C8H13F3O2/c1-6(2)4-3-5-13-7(12)8(9,10)11/h6H,3-5H2,1-2H3
InChIKey YVQDQJNIGSBFAW-UHFFFAOYSA-N
Mol Weight 198.19 g/mol
Molecular Formula C8H13F3O2
Exact Mass 198.086764 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3700s2GYfpL
Name 4-Methylpentyl trifluoroacetate
CAS Registry Number 327-71-9
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H13F3O2
InChI InChI=1S/C8H13F3O2/c1-6(2)4-3-5-13-7(12)8(9,10)11/h6H,3-5H2,1-2H3
InChIKey YVQDQJNIGSBFAW-UHFFFAOYSA-N
Molecular Weight 198.185 g/mol
SMILES CC(CCCOC(C(F)(F)F)=O)C
SPLASH splash10-05tf-9000000000-5b746ae80f6c077baaf8
Source of Spectrum NP-3-9629-0
Synonyms Trifluoroacetic acid, 4-methylpentyl ester 2,2,2-trifluoroacetic acid 4-methylpentyl ester 4-Methylpentyl 2,2,2-trifluoroacetate isohexyl 2,2,2-trifluoroacetate 4-Methylpentyl 2,2,2-tris(fluoranyl)ethanoate
Wiley ID 1103394