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2-(2,2,2-trifluoro-1-hydroxy-ethyl)pent-4-enoic acid ethyl ester
SpectraBase Compound ID 8KnmG84A9Aa
InChI InChI=1S/C9H13F3O3/c1-3-5-6(8(14)15-4-2)7(13)9(10,11)12/h3,6-7,13H,1,4-5H2,2H3
InChIKey YBAHDQHRTQXLDX-UHFFFAOYSA-N
Mol Weight 226.2 g/mol
Molecular Formula C9H13F3O3
Exact Mass 226.081679 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID h25rXCiCmA
Name 4-PENTENOIC ACID, 2-(2,2,2-TRIFLUORO-1-HYDROXYETHYL)-, ETHYL ESTER, [R-(R*,S*)]-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H13O3F3
InChI InChI=1S/C9H13F3O3/c1-3-5-6(8(14)15-4-2)7(13)9(10,11)12/h3,6-7,13H,1,4-5H2,2H3
InChIKey YBAHDQHRTQXLDX-UHFFFAOYSA-N
Molecular Weight 226.0813
SMILES OC(C(F)(F)F)C(CC=C)C(=O)OCC
SPLASH splash10-004i-9500000000-d83df1875083b8dee8dd
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