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1-((2S,3S)-2-(4-methoxyphenyl)-3-(trifluoromethyl)tetrahydro-2H-pyran-2-yl)propan-1-one
SpectraBase Compound ID FbD5IQpcFR4
InChI InChI=1S/C16H19F3O3/c1-3-14(20)15(11-6-8-12(21-2)9-7-11)13(16(17,18)19)5-4-10-22-15/h6-9,13H,3-5,10H2,1-2H3/t13-,15+/m0/s1
InChIKey GFLLWIUEQYQQFC-DZGCQCFKSA-N
Mol Weight 316.32 g/mol
Molecular Formula C16H19F3O3
Exact Mass 316.128629 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9DbzbzF3DCs
Name 1-((2S,3S)-2-(4-methoxyphenyl)-3-(trifluoromethyl)tetrahydro-2H-pyran-2-yl)propan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H19F3O3
InChI InChI=1S/C16H19F3O3/c1-3-14(20)15(11-6-8-12(21-2)9-7-11)13(16(17,18)19)5-4-10-22-15/h6-9,13H,3-5,10H2,1-2H3/t13-,15+/m0/s1
InChIKey GFLLWIUEQYQQFC-DZGCQCFKSA-N
Literature Reference DOI 10.1002/anie.201304557
Molecular Weight 316.320 g/mol
SMILES C1CC[C@@]([C@](O1)(c1ccc(cc1)OC)C(=O)CC)(C(F)(F)F)[H]
SPLASH splash10-0a4r-0590000000-d348618d85d6856c3b3c
Source of Spectrum ACI-52-SMS10-2i
Wiley ID 1781668