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5-(4-Trifluoromethylbenzyl)hepta-3,4-diene
SpectraBase Compound ID 5cgWvyRMerU
InChI InChI=1S/C15H17F3/c1-3-5-6-12(4-2)11-13-7-9-14(10-8-13)15(16,17)18/h5,7-10H,3-4,11H2,1-2H3
InChIKey SCLPIVXOWKFXMN-UHFFFAOYSA-N
Mol Weight 254.3 g/mol
Molecular Formula C15H17F3
Exact Mass 254.128235 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CQzkBDFYrK0
Name 5-(4-Trifluoromethylbenzyl)hepta-3,4-diene
Appearance Colourless oil
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Exact Mass 254.128235036 u
Formula C15H17F3
InChI InChI=1S/C15H17F3/c1-3-5-6-12(4-2)11-13-7-9-14(10-8-13)15(16,17)18/h5,7-10H,3-4,11H2,1-2H3
InChIKey SCLPIVXOWKFXMN-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/adsc.202201211
Molecular Weight 254.296 g/mol
Quality 216
Reported Formula C15H17F3
SMILES C(C1=CC=C(C=C1)CC(=C=CCC)CC)(F)(F)F
SPLASH splash10-056s-1790000000-369e58ee6437e6fb0358
Source of Spectrum ASC-365-SM31-2p (DOI: 10.1002/adsc.202201211)
Wiley ID 1902730