John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=12PIZI0tHQ1 SpectraBase Spectrum ID=LgkR3nY5C8L

(accessed ).
5-AMINO-7-(4-BROMOPHENYL)-1,7-DIHYDROPYRANO-[3,2-B]-PYRROLE-6-CARBONITRILE
SpectraBase Compound ID 12PIZI0tHQ1
InChI InChI=1S/C14H10BrN3O/c15-9-3-1-8(2-4-9)12-10(7-16)14(17)19-11-5-6-18-13(11)12/h1-6,12,18H,17H2
InChIKey WDQJAACFRROPQU-UHFFFAOYSA-N
Mol Weight 316.16 g/mol
Molecular Formula C14H10BrN3O
Exact Mass 315.000723 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LgkR3nY5C8L
Name 5-AMINO-7-(4-BROMOPHENYL)-1,7-DIHYDROPYRANO-[3,2-B]-PYRROLE-6-CARBONITRILE
Compound Number 5D
Copyright Copyright © 2016-2020 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H10BrN3O
InChI InChI=1S/C14H10BrN3O/c15-9-3-1-8(2-4-9)12-10(7-16)14(17)19-11-5-6-18-13(11)12/h1-6,12,18H,17H2
InChIKey WDQJAACFRROPQU-UHFFFAOYSA-N
Literature Reference Author R.SANDAROOS,S.DAMAVANDI
Literature Reference Citation J.CHEM.SCI.,124,893(2012)
Literature Reference DOI 10.1007/s12039-012-0262-0
Molecular Weight 316.157 g/mol
Solvent CDCl3
Source File Reference UWBT11504
SpectraBase Batch ID DAObR3kbnoI