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((2R,3S)-3-azido-2-(4-(trifluoromethyl)phenyl)tetrahydro-2H-pyran-2-yl)(4-(trifluoromethyl)phenyl)methanone
SpectraBase Compound ID G6xNokPDcPP
InChI InChI=1S/C20H15F6N3O2/c21-19(22,23)14-5-3-12(4-6-14)17(30)18(16(28-29-27)2-1-11-31-18)13-7-9-15(10-8-13)20(24,25)26/h3-10,16H,1-2,11H2/t16-,18+/m0/s1
InChIKey VOLPLKAKUPSGCM-FUHWJXTLSA-N
Mol Weight 443.35 g/mol
Molecular Formula C20H15F6N3O2
Exact Mass 443.106846 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FYm97K3GDmq
Name ((2R,3S)-3-azido-2-(4-(trifluoromethyl)phenyl)tetrahydro-2H-pyran-2-yl)(4-(trifluoromethyl)phenyl)methanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H15F6N3O2
InChI InChI=1S/C20H15F6N3O2/c21-19(22,23)14-5-3-12(4-6-14)17(30)18(16(28-29-27)2-1-11-31-18)13-7-9-15(10-8-13)20(24,25)26/h3-10,16H,1-2,11H2/t16-,18+/m0/s1
InChIKey VOLPLKAKUPSGCM-FUHWJXTLSA-N
Literature Reference DOI 10.1039/c4cc04707a
Molecular Weight 443.349 g/mol
SMILES C1CC[C@@]([C@](c2ccc(cc2)C(F)(F)F)(C(c2ccc(cc2)C(F)(F)F)=O)O1)(N=[N+]=[N-])[H]
SPLASH splash10-00xs-6910000000-ecc65fb5f20c3edd7775
Source of Spectrum KD-50-10805/SMS22-2o
Wiley ID 1754812