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(2SR,10RS)-10-BROM-3-PHENYL-5,8-DIOXA-4-AZATETRACYCLO-[7.4.0.0.0]-TRIDEC-3-EN-7-ONE
SpectraBase Compound ID 8bW3XSSv9vg
InChI InChI=1S/C16H14BrNO3/c17-12-10-7-6-9-11-13(8-4-2-1-3-5-8)18-21-16(10,11)15(19)20-14(9)12/h1-5,9-12,14H,6-7H2/t9-,10-,11-,12+,14+,16-/m0/s1
InChIKey IXTBEJFNPQHPSQ-MRDDJVRASA-N
Mol Weight 348.2 g/mol
Molecular Formula C16H14BrNO3
Exact Mass 347.015706 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6r6bO07zg51
Name (2SR,10RS)-10-BROM-3-PHENYL-5,8-DIOXA-4-AZATETRACYCLO-[7.4.0.0.0]-TRIDEC-3-EN-7-ONE
CAS Registry Number 124287-06-5
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H14BrNO3
InChI InChI=1S/C16H14BrNO3/c17-12-10-7-6-9-11-13(8-4-2-1-3-5-8)18-21-16(10,11)15(19)20-14(9)12/h1-5,9-12,14H,6-7H2/t9-,10-,11-,12+,14+,16-/m0/s1
InChIKey IXTBEJFNPQHPSQ-MRDDJVRASA-N
Literature Reference Author R.NESI,D.GIOMI,S.PAPALEO,M.CORTI
Literature Reference Citation J.ORG.CHEM.,55,1227(1990)
Literature Reference DOI 10.1021/jo00291a023
Molecular Weight 348.196 g/mol
Solvent CDCl3
Source File Reference UWED9963