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2-[7-(TRIFLUOROACETYL)-CYCLOPENTA-[C]-PYRAN-3-YL]-ETHANOL

View entire compound with spectra: 2 NMR, and 1 MS (GC)

2-[7-(TRIFLUOROACETYL)-CYCLOPENTA-[C]-PYRAN-3-YL]-ETHANOL
SpectraBase Compound ID 9WPWlfHr9ab
InChI InChI=1S/C12H9F3O3/c13-12(14,15)11(17)9-2-1-7-5-8(3-4-16)18-6-10(7)9/h1-2,5-6,16H,3-4H2
InChIKey MJVMWENXFVLBFK-UHFFFAOYSA-N
Mol Weight 258.2 g/mol
Molecular Formula C12H9F3O3
Exact Mass 258.050379 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 66bL7XXJZct
Name 2,2,2-trifluoro-1-[3-(2-hydroxyethyl)-7-cyclopenta[c]pyranyl]ethanone
Alternate Name(s) 2,2,2-trifluoro-1-[3-(2-hydroxyethyl)cyclopenta[c]pyran-7-yl]ethanone 2,2,2-tris(fluoranyl)-1-[3-(2-hydroxyethyl)cyclopenta[c]pyran-7-yl]ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H9F3O3
InChI InChI=1S/C12H9F3O3/c13-12(14,15)11(17)9-2-1-7-5-8(3-4-16)18-6-10(7)9/h1-2,5-6,16H,3-4H2
InChIKey MJVMWENXFVLBFK-UHFFFAOYSA-N
Molecular Weight 258.196 g/mol
SMILES OCCC1=CC=2C(=CO1)C(=CC2)C(=O)C(F)(F)F
SPLASH splash10-052r-0920000000-9846c141c9659d8fc95c
Source of Spectrum K1-0-540-25
Wiley ID 1588314