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2-[(R)-ALPHA-DIFLUOROBORYLOXY-ALPHA-(TRIFLUOROMETHYL)-BENZYL]-(S)-6-METHYL-5,6-DIHYDRO-4H-1,3-OXAZINE
SpectraBase Compound ID 1KfQdiqY3Ty
InChI InChI=1S/C13H13BF5NO2/c1-9-7-8-20-11(21-9)12(13(15,16)17,22-14(18)19)10-5-3-2-4-6-10/h2-6,9H,7-8H2,1H3/t9-,12+/m0/s1
InChIKey DQZNBCDFCAOYHQ-JOYOIKCWSA-N
Mol Weight 321.1 g/mol
Molecular Formula C13H13BF5NO2
Exact Mass 321.09595 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 35K5TwzSlV8
Name 2-[(R)-ALPHA-DIFLUOROBORYLOXY-ALPHA-(TRIFLUOROMETHYL)-BENZYL]-(S)-6-METHYL-5,6-DIHYDRO-4H-1,3-OXAZINE
Compound Number 5A-(R)-(S)
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H13BF5NO2
InChI InChI=1S/C13H13BF5NO2/c1-9-7-8-20-11(21-9)12(13(15,16)17,22-14(18)19)10-5-3-2-4-6-10/h2-6,9H,7-8H2,1H3/t9-,12+/m0/s1
InChIKey DQZNBCDFCAOYHQ-JOYOIKCWSA-N
Literature Reference Author A.NABEYA,T.ENDO,T.NISHIGUCHI,K.HORI
Literature Reference Citation J.ORG.CHEM.,64,5686(1999)
Literature Reference DOI 10.1021/jo981901h
Solvent C6D6
Source File Reference UWSI40358