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trifluoroacetic acid, butyl ester
SpectraBase Compound ID Cu6dzFu3Eo
InChI InChI=1S/C6H9F3O2/c1-2-3-4-11-5(10)6(7,8)9/h2-4H2,1H3
InChIKey CLDYDTBRUJPBGU-UHFFFAOYSA-N
Mol Weight 170.13 g/mol
Molecular Formula C6H9F3O2
Exact Mass 170.055464 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2nB3jRTeXpo
Name Butanol TFA
CAS Registry Number 367-64-6
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 170.055464017 u
Formula C6H9F3O2
InChI InChI=1S/C6H9F3O2/c1-2-3-4-11-5(10)6(7,8)9/h2-4H2,1H3
InChIKey CLDYDTBRUJPBGU-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 170.131 g/mol
Nominal Mass 170 u
Quality 1000
Retention Index 1143
SMILES C(C(F)(F)F)(OCCCC)=O
SPLASH splash10-052f-9000000000-17c08fef31677e16374c
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Butyl trifluoroacetate
Technique GC/MS
Wiley ID DD2024_022298