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(4R, 6S)-6-Hydroxy-4-phenyl-2-propyl-6-(trichloromethyl)-5,6-dihydro-4H-pyran-3-carbonitrile
SpectraBase Compound ID HXIvj6tfSaX
InChI InChI=1S/C16H16Cl3NO2/c1-2-6-14-13(10-20)12(11-7-4-3-5-8-11)9-15(21,22-14)16(17,18)19/h3-5,7-8,12,21H,2,6,9H2,1H3/t12-,15+/m1/s1
InChIKey ZIQNITHFECEFME-DOMZBBRYSA-N
Mol Weight 360.67 g/mol
Molecular Formula C16H16Cl3NO2
Exact Mass 359.024662 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FUPMfUejiPf
Name (4R, 6S)-6-Hydroxy-4-phenyl-2-propyl-6-(trichloromethyl)-5,6-dihydro-4H-pyran-3-carbonitrile
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Formula C16H16Cl3NO2
InChI InChI=1S/C16H16Cl3NO2/c1-2-6-14-13(10-20)12(11-7-4-3-5-8-11)9-15(21,22-14)16(17,18)19/h3-5,7-8,12,21H,2,6,9H2,1H3/t12-,15+/m1/s1
InChIKey ZIQNITHFECEFME-DOMZBBRYSA-N
Molecular Weight 360.668 g/mol
SMILES O[C@@]1(OC(CCC)=C([C@](C1)(c1ccccc1)[H])C#N)C(Cl)(Cl)Cl
SPLASH splash10-00dl-9400000000-1bef28d8e7e99449b5b4
Source of Spectrum F-67-1779-9p
Wiley ID 1685903