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anti-5,6,6a,7,13,13a-Hexahydro-dibenzo[3,4][9,10]-7,13-methanoquino[3,4-c][1]benzazepine

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anti-5,6,6a,7,13,13a-Hexahydro-dibenzo[3,4][9,10]-7,13-methanoquino[3,4-c][1]benzazepine
SpectraBase Compound ID 7vuO1wJOgBQ
InChI InChI=1S/C26H22N2/c1-3-7-17-15(5-1)10-12-20-24-21-13-23(22(24)14-27-25(17)20)28-26-18-8-4-2-6-16(18)9-11-19(21)26/h1-12,21-24,27-28H,13-14H2/t21?,22-,23+,24+/m1/s1
InChIKey MQQGPHJGMWWERN-KCNMBCDYSA-N
Mol Weight 362.48 g/mol
Molecular Formula C26H22N2
Exact Mass 362.178299 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EqVrZ2jddCF
Name ANTI-5,6,6A,7,13,13A-HEXAHYDRO-DIBENZO-[3,4]-[9,10]-7,13-METHANO-QUINO-[3,4-C]-[1]-BENZAZEPINE
Compound Number 3 F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H22N2
InChI InChI=1S/C26H22N2/c1-3-7-17-15(5-1)10-12-20-24-21-13-23(22(24)14-27-25(17)20)28-26-18-8-4-2-6-16(18)9-11-19(21)26/h1-12,21-24,27-28H,13-14H2/t21?,22-,23+,24+/m1/s1
InChIKey MQQGPHJGMWWERN-KCNMBCDYSA-N
Literature Reference Author J.C.GAUFFRE,M.GRIGNON-DUBOIS,B.REZZONICO,J.M.LEGER
Literature Reference Citation J.ORG.CHEM.,67,4696(2002)
Literature Reference DOI 10.1021/jo010961b
Molecular Weight 362.474 g/mol
Solvent CDCl3
Source File Reference UWSI21740