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(E)-1,1,1-Trifluoro-4-(phenyl-N-1-propyn-3-ylamino)-oct-3-en-2-one
SpectraBase Compound ID DGsaeovlCwM
InChI InChI=1S/C17H18F3NO/c1-3-5-9-15(13-16(22)17(18,19)20)21(12-4-2)14-10-7-6-8-11-14/h2,6-8,10-11,13H,3,5,9,12H2,1H3/b15-13+
InChIKey WJBBMXSNUNGWLC-FYWRMAATSA-N
Mol Weight 309.33 g/mol
Molecular Formula C17H18F3NO
Exact Mass 309.134049 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JupE5dOveun
Name (E)-1,1,1-Trifluoro-4-(phenyl-N-1-propyn-3-ylamino)-oct-3-en-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18F3NO
InChI InChI=1S/C17H18F3NO/c1-3-5-9-15(13-16(22)17(18,19)20)21(12-4-2)14-10-7-6-8-11-14/h2,6-8,10-11,13H,3,5,9,12H2,1H3/b15-13+
InChIKey WJBBMXSNUNGWLC-FYWRMAATSA-N
Instrument Name Agilent 6890N-G1530CN GC
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0011.902
Molecular Weight 309.332 g/mol
SMILES C(C(\C=C/(CCCC)N(c1ccccc1)CC#C)=O)(F)(F)F
SPLASH splash10-014i-1192000000-5567cbbeb483a2dc1956
Source of Spectrum ARK-2010-SM3-6d
Wiley ID 1869988