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2-PARA-TOLYL-5,8-METHANO-4AS*,5,6S*,7S*,8,8AR*-HEXAHYDRO-4H-3,1-BENZOXAZINO-[7,6-D]-3-PHENYLISOXAZOLINE
SpectraBase Compound ID BYIE6uViaLm
InChI InChI=1S/C23H22N2O2/c1-13-7-9-15(10-8-13)23-24-21-17-11-16(18(21)12-26-23)22-19(17)20(25-27-22)14-5-3-2-4-6-14/h2-10,16-19,21-22H,11-12H2,1H3/t16-,17-,18-,19-,21+,22-/m0/s1
InChIKey XQLRTGVCOYJJLH-GUUIKRHKSA-N
Mol Weight 358.44 g/mol
Molecular Formula C23H22N2O2
Exact Mass 358.168128 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3FBzFoYQ78b
Name 2-PARA-TOLYL-5,8-METHANO-4AS*,5,6S*,7S*,8,8AR*-HEXAHYDRO-4H-3,1-BENZOXAZINO-[7,6-D]-3-PHENYLISOXAZOLINE
Compound Number 15
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H22N2O2
InChI InChI=1S/C23H22N2O2/c1-13-7-9-15(10-8-13)23-24-21-17-11-16(18(21)12-26-23)22-19(17)20(25-27-22)14-5-3-2-4-6-14/h2-10,16-19,21-22H,11-12H2,1H3/t16-,17-,18-,19-,21+,22-/m0/s1
InChIKey XQLRTGVCOYJJLH-GUUIKRHKSA-N
Literature Reference Author P.SOHAR,G.STAJER,G.BERNATH
Literature Reference Citation MAGN.RES.CHEM.,25,635(1987)
Literature Reference DOI 10.1002/mrc.1260250715
Molecular Weight 358.440 g/mol
Solvent CDCl3
Source File Reference UWGB804