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1-(5-CHLOROPENTYL)-6-NITRO-DIHYDROCINNOLIN-3-OL
SpectraBase Compound ID B3bslwH6ZEZ
InChI InChI=1S/C13H16ClN3O3/c14-6-2-1-3-7-16-12-5-4-11(17(19)20)8-10(12)9-13(18)15-16/h4-5,8H,1-3,6-7,9H2,(H,15,18)
InChIKey JTTGPUKBXOHBGW-UHFFFAOYSA-N
Mol Weight 297.74 g/mol
Molecular Formula C13H16ClN3O3
Exact Mass 297.088019 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1sIXCsATQNb
Name 1-(5-CHLOROPENTYL)-6-NITRO-DIHYDROCINNOLIN-3-OL
Compound Number 19A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H16ClN3O3
InChI InChI=1S/C13H16ClN3O3/c14-6-2-1-3-7-16-12-5-4-11(17(19)20)8-10(12)9-13(18)15-16/h4-5,8H,1-3,6-7,9H2,(H,15,18)
InChIKey JTTGPUKBXOHBGW-UHFFFAOYSA-N
Literature Reference Author V.J.ARAN,J.L.ASENSIO,J.MOLINA,P.MUNOZ,J.R.RUIZ,M.STUD
Literature Reference Citation J.CHEM.SOC.PERKIN-1,2229(1997)
Literature Reference DOI 10.1039/a701103b
Molecular Weight 297.741 g/mol
Solvent DMSO-D6
Source File Reference UWRU9168