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2,4-DIMETHYL-4-(ORTHO-METHOXYPHENYL)-6-(PHENYLMETHYLENE)-5H-PYRAZOLO-[1,5-D]-[2,4]-BENZOXAZEPINE
SpectraBase Compound ID 2v89O3WV8xD
InChI InChI=1S/C27H24N2O2/c1-19-17-24-21-13-7-8-14-22(21)26(18-20-11-5-4-6-12-20)31-27(2,29(24)28-19)23-15-9-10-16-25(23)30-3/h4-18H,1-3H3/b26-18-/t27-/m1/s1
InChIKey SXGKURVQSBTLCM-KAOBMCRLSA-N
Mol Weight 408.5 g/mol
Molecular Formula C27H24N2O2
Exact Mass 408.183778 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EbUbLLmH3MJ
Name 2,4-DIMETHYL-4-(ORTHO-METHOXYPHENYL)-6-(PHENYLMETHYLENE)-5H-PYRAZOLO-[1,5-D]-[2,4]-BENZOXAZEPINE
Compound Number 9F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H24N2O2
InChI InChI=1S/C27H24N2O2/c1-19-17-24-21-13-7-8-14-22(21)26(18-20-11-5-4-6-12-20)31-27(2,29(24)28-19)23-15-9-10-16-25(23)30-3/h4-18H,1-3H3/b26-18-/t27-/m1/s1
InChIKey SXGKURVQSBTLCM-KAOBMCRLSA-N
Literature Reference Author E.E.SCHWEIZER,Z.CAO,A.L.RHEINGOLD,M.BRUCH
Literature Reference Citation J.ORG.CHEM.,58,4339(1993)
Literature Reference DOI 10.1021/jo00068a032
Molecular Weight 408.500 g/mol
Solvent CDCl3
Source File Reference UWGE2233