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(1S)-1-phenyl-1-(3,3,3-trifluoropropyl)-3,6-dihydro-2H-siline-5-carbaldehyde
SpectraBase Compound ID LNX2qdQWOYQ
InChI InChI=1S/C15H17F3OSi/c16-15(17,18)8-10-20(14-6-2-1-3-7-14)9-4-5-13(11-19)12-20/h1-3,5-7,11H,4,8-10,12H2/t20-/m0/s1
InChIKey CEGJRDJNVNMYDY-FQEVSTJZSA-N
Mol Weight 298.38 g/mol
Molecular Formula C15H17F3OSi
Exact Mass 298.100076 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 28usYAkaAeq
Name (1S)-1-phenyl-1-(3,3,3-trifluoropropyl)-3,6-dihydro-2H-siline-5-carbaldehyde
Appearance Colorless oil
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Exact Mass 298.100076190 u
Formula C15H17F3OSi
InChI InChI=1S/C15H17F3OSi/c16-15(17,18)8-10-20(14-6-2-1-3-7-14)9-4-5-13(11-19)12-20/h1-3,5-7,11H,4,8-10,12H2/t20-/m0/s1
InChIKey CEGJRDJNVNMYDY-FQEVSTJZSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1002/anie.202217724
Molecular Weight 298.380 g/mol
Optical Rotation [a]D20 = -23.4 (c = 0.63, CHCl3)
Quality 921
Reported Formula C15H17F3OSi
SMILES C1=CC(=CC=C1)[Si@]1(CC(=CCC1)C=O)CCC(F)(F)F
SPLASH splash10-002f-4900000000-78c0e465b502c547466b
Sample Comments 94% ee
Source of Spectrum ACI-62-SM8-2a (DOI: 10.1002/anie.202217724)
Wiley ID 1911218