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((2S,3S)-2-(4-nitrophenyl)-3-(trifluoromethyl)tetrahydro-2H-pyran-2-yl)(phenyl)methanone
SpectraBase Compound ID Bq7t5MwyUE1
InChI InChI=1S/C19H16F3NO4/c20-19(21,22)16-7-4-12-27-18(16,17(24)13-5-2-1-3-6-13)14-8-10-15(11-9-14)23(25)26/h1-3,5-6,8-11,16H,4,7,12H2/t16-,18+/m0/s1
InChIKey YWZRSJHCLSKDCH-FUHWJXTLSA-N
Mol Weight 379.34 g/mol
Molecular Formula C19H16F3NO4
Exact Mass 379.103142 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9FHA4n7JBkU
Name ((2S,3S)-2-(4-nitrophenyl)-3-(trifluoromethyl)tetrahydro-2H-pyran-2-yl)(phenyl)methanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H16F3NO4
InChI InChI=1S/C19H16F3NO4/c20-19(21,22)16-7-4-12-27-18(16,17(24)13-5-2-1-3-6-13)14-8-10-15(11-9-14)23(25)26/h1-3,5-6,8-11,16H,4,7,12H2/t16-,18+/m0/s1
InChIKey YWZRSJHCLSKDCH-FUHWJXTLSA-N
Literature Reference DOI 10.1002/anie.201304557
Molecular Weight 379.335 g/mol
SMILES C1CC[C@](C(F)(F)F)([C@@](C(=O)c2ccccc2)(c2ccc(cc2)[N+](=O)[O-])O1)[H]
SPLASH splash10-0a6r-3960000000-682957bf7cf7f46ff888
Source of Spectrum ACI-52-SMS8-2f
Wiley ID 1781665