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3-allyl-4-(benzyl)-2-methyl-6,7-di(phenyl)-4H-pyrazolo[5,1-c][1,4]oxazine
SpectraBase Compound ID EiXNMe04yei
InChI InChI=1S/C29H26N2O/c1-3-13-25-21(2)30-31-27(23-16-9-5-10-17-23)29(24-18-11-6-12-19-24)32-26(28(25)31)20-22-14-7-4-8-15-22/h3-12,14-19,26H,1,13,20H2,2H3
InChIKey WRLGKOMKORJECH-UHFFFAOYSA-N
Mol Weight 418.54 g/mol
Molecular Formula C29H26N2O
Exact Mass 418.204513 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3LP4vjaNFs9
Name 3-allyl-4-(benzyl)-2-methyl-6,7-di(phenyl)-4H-pyrazolo[5,1-c][1,4]oxazine
Compound Number 986
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H26N2O
InChI InChI=1S/C29H26N2O/c1-3-13-25-21(2)30-31-27(23-16-9-5-10-17-23)29(24-18-11-6-12-19-24)32-26(28(25)31)20-22-14-7-4-8-15-22/h3-12,14-19,26H,1,13,20H2,2H3
InChIKey WRLGKOMKORJECH-UHFFFAOYSA-N
Literature Reference Author M.BEGTRUP,G.BOYER,P.CABILDO,C.CATIVIELA,R.M.CLARAMUNT,J.ELGU ERO,J.I.GARCIA,C.TOI
Literature Reference Citation MAGN.RES.CHEM.,31,107(1993)
Literature Reference DOI 10.1002/mrc.1260310202
Molecular Weight 418.538 g/mol
Solvent CDCl3
Source File Reference UWVP2263