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3-(3'-Hydroxypropyl)-4-(diethylamino)-1,1,1-trifluorobut-3-en-2-one
SpectraBase Compound ID KF4TgfBirV8
InChI InChI=1S/C11H18F3NO2/c1-3-15(4-2)8-9(6-5-7-16)10(17)11(12,13)14/h8,16H,3-7H2,1-2H3/b9-8-
InChIKey SJGFWYSETNAJJL-HJWRWDBZSA-N
Mol Weight 253.27 g/mol
Molecular Formula C11H18F3NO2
Exact Mass 253.128963 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1anUiDZLt29
Name 3-(3'-Hydroxypropyl)-4-(diethylamino)-1,1,1-trifluorobut-3-en-2-one
Alternate Name(s) (3Z)-4-(diethylamino)-1,1,1-trifluoro-3-(3-hydroxypropyl)-3-buten-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H18F3NO2
InChI InChI=1S/C11H18F3NO2/c1-3-15(4-2)8-9(6-5-7-16)10(17)11(12,13)14/h8,16H,3-7H2,1-2H3/b9-8-
InChIKey SJGFWYSETNAJJL-HJWRWDBZSA-N
Molecular Weight 253.265 g/mol
SMILES OCCC\C(C(C(F)(F)F)=O)=C\N(CC)CC
SPLASH splash10-0udi-0490000000-2c27016cbb4ec6b61445
Source of Spectrum AH-130-677-4
Wiley ID 770591