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NJIHTXWIAQGYCH-UHFFFAOYSA-N

View entire compound with spectra: 1 NMR

NJIHTXWIAQGYCH-UHFFFAOYSA-N
SpectraBase Compound ID HrOTdhjY0Fy
InChI InChI=1S/C16H14ClN3O4/c1-16(2)23-14(21)11(15(22)24-16)8-18-13-7-12(19-20-13)9-3-5-10(17)6-4-9/h3-8H,1-2H3,(H2,18,19,20)
InChIKey NJIHTXWIAQGYCH-UHFFFAOYSA-N
Mol Weight 347.76 g/mol
Molecular Formula C16H14ClN3O4
Exact Mass 347.067284 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Bhjj6Czd4X5
Name NJIHTXWIAQGYCH-UHFFFAOYSA-N
Compound Number 2D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H14ClN3O4
InChI InChI=1S/C16H14ClN3O4/c1-16(2)23-14(21)11(15(22)24-16)8-18-13-7-12(19-20-13)9-3-5-10(17)6-4-9/h3-8H,1-2H3,(H2,18,19,20)
InChIKey NJIHTXWIAQGYCH-UHFFFAOYSA-N
Literature Reference Author J.QUIROGA,A.HORMAZA,B.INSUASTY,C.SAITZ,C.JULLIAN,A.CANETE
Literature Reference Citation J.HETCYCL.CHEM.,35,61(1998)
Literature Reference DOI 10.1002/jhet.5570350112
Molecular Weight 347.758 g/mol
Solvent DMSO-D6
Source File Reference UWCP8921