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3-(Hydroxypropyl)-4-(phenylamino)-1,1,1-trifluorobut-3-en-2-one
SpectraBase Compound ID D3xM1nFfbnk
InChI InChI=1S/C13H14F3NO2/c14-13(15,16)12(19)10(5-4-8-18)9-17-11-6-2-1-3-7-11/h1-3,6-7,9,17-18H,4-5,8H2/b10-9-
InChIKey JVSFVLNTDFUFGD-KTKRTIGZSA-N
Mol Weight 273.26 g/mol
Molecular Formula C13H14F3NO2
Exact Mass 273.097663 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gm7n8lBG3fH
Name 3-(Hydroxypropyl)-4-(phenylamino)-1,1,1-trifluorobut-3-en-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14F3NO2
InChI InChI=1S/C13H14F3NO2/c14-13(15,16)12(19)10(5-4-8-18)9-17-11-6-2-1-3-7-11/h1-3,6-7,9,17-18H,4-5,8H2/b10-9-
InChIKey JVSFVLNTDFUFGD-KTKRTIGZSA-N
Molecular Weight 273.255 g/mol
SMILES N(\C=C\(CCCO)C(C(F)(F)F)=O)c1ccccc1
SPLASH splash10-0059-1490000000-a05cb887f4288e20dab5
Source of Spectrum AH-130-677-4
Synonyms (3Z)-4-anilino-1,1,1-trifluoro-3-(3-hydroxypropyl)-3-buten-2-one
Wiley ID 770593