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(Z)-1,1,1-Trifluoro-13-octadecen-2-one
SpectraBase Compound ID Abach05O131
InChI InChI=1S/C18H31F3O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(22)18(19,20)21/h5-6H,2-4,7-16H2,1H3/b6-5-
InChIKey CMVYUUYNWUMURT-WAYWQWQTSA-N
Mol Weight 320.44 g/mol
Molecular Formula C18H31F3O
Exact Mass 320.2327 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7A3iNJyqNzr
Name (Z)-1,1,1-Trifluoro-13-octadecen-2-one
Alternate Name(s) (Z)-1,1,1-tris(fluoranyl)octadec-13-en-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H31F3O
InChI InChI=1S/C18H31F3O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(22)18(19,20)21/h5-6H,2-4,7-16H2,1H3/b6-5-
InChIKey CMVYUUYNWUMURT-WAYWQWQTSA-N
Molecular Weight 320.440 g/mol
SMILES C(C(=O)CCCCCCCCCC\C=C/CCCC)(F)(F)F
SPLASH splash10-0a4l-9000000000-7d471e894ad76cfc4fca
Source of Spectrum F-50-12681-5
Wiley ID 789948