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R(N),S(C)-(-)-1-(1-N-1-PHENYLETHYLCARBAMOYL-1-METHYLETHOXY)-2,2-BIS(TRIFLUOROMETHYL)AZIRIDINE
SpectraBase Compound ID 2Xinf1CyTE7
InChI InChI=1S/C16H18F6N2O2/c1-10(11-7-5-4-6-8-11)23-12(25)13(2,3)26-24-9-14(24,15(17,18)19)16(20,21)22/h4-8,10H,9H2,1-3H3,(H,23,25)/t10-,24?/m1/s1
InChIKey ALJGKTYACADCJF-URGTUCKKSA-N
Mol Weight 384.32 g/mol
Molecular Formula C16H18F6N2O2
Exact Mass 384.127247 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1PzVpp2o3MN
Name R(N),S(C)-(-)-1-(1-N-1-PHENYLETHYLCARBAMOYL-1-METHYLETHOXY)-2,2-BIS(TRIFLUOROMETHYL)AZIRIDINE
Comments SCALE INVERTED. RONTGEN. ABSOLUTE STEREOCONFIGURATION!
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C16H18F6N2O2
InChI InChI=1S/C16H18F6N2O2/c1-10(11-7-5-4-6-8-11)23-12(25)13(2,3)26-24-9-14(24,15(17,18)19)16(20,21)22/h4-8,10H,9H2,1-3H3,(H,23,25)/t10-,24?/m1/s1
InChIKey ALJGKTYACADCJF-URGTUCKKSA-N
Instrument Name Jeol FX-60
Literature Reference R.G.KOSTYANOVSKY, G.K.KADORKINA, A.B.ZOLOTOI, O.A.D'YACHENKO, L.O.ATOVMYAN,I.I.CHERVIN, SH.S.NASIBOV (1983) Dokl.Akad.Nauk SSSR(Russ. Lang.): v.269, N5,1103-1106.
NMR Standard -CF3COOH
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported