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Diethyl diethyl 2-(prop-2-yn-1-yl)-2-(3,3,3-trifluoro-1-phenylpropyl)malonate
SpectraBase Compound ID 5KEKojNvQOv
InChI InChI=1S/C19H21F3O4/c1-4-12-18(16(23)25-5-2,17(24)26-6-3)15(13-19(20,21)22)14-10-8-7-9-11-14/h1,7-11,15H,5-6,12-13H2,2-3H3
InChIKey WPQBIEPLNXYMSY-UHFFFAOYSA-N
Mol Weight 370.37 g/mol
Molecular Formula C19H21F3O4
Exact Mass 370.139194 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FB9AbWOJxEs
Name Diethyl diethyl 2-(prop-2-yn-1-yl)-2-(3,3,3-trifluoro-1-phenylpropyl)malonate
Appearance Pale yellow oil
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Formula C19H21F3O4
InChI InChI=1S/C19H21F3O4/c1-4-12-18(16(23)25-5-2,17(24)26-6-3)15(13-19(20,21)22)14-10-8-7-9-11-14/h1,7-11,15H,5-6,12-13H2,2-3H3
InChIKey WPQBIEPLNXYMSY-UHFFFAOYSA-N
Instrument Name Agilent Technologies 5973N
Ionization Type EI
Literature Reference DOI 10.1002/anie.202010839
Molecular Weight 370.368 g/mol
SMILES C(=O)(C(C(CC(F)(F)F)c1ccccc1)(C(=O)OCC)CC#C)OCC
SPLASH splash10-05fr-0930000000-62d06f3565c35455e546
Source of Spectrum ACI-60-SM35-9
Wiley ID 1880190