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2-amino-4-(3-iodophenyl)-6-methyl-5-(5-nitrotetrazol-2-yl)-4H-pyran-3-carbonitrile

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2-amino-4-(3-iodophenyl)-6-methyl-5-(5-nitrotetrazol-2-yl)-4H-pyran-3-carbonitrile
SpectraBase Compound ID 6cSGDbVPuGu
InChI InChI=1S/C14H10IN7O3/c1-7-12(21-19-14(18-20-21)22(23)24)11(10(6-16)13(17)25-7)8-3-2-4-9(15)5-8/h2-5,11H,17H2,1H3
InChIKey XKQSEQUQIUABHX-UHFFFAOYSA-N
Mol Weight 451.18 g/mol
Molecular Formula C14H10IN7O3
Exact Mass 450.988982 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1ceHa591vwc
Name 2-amino-4-(3-iodophenyl)-6-methyl-5-(5-nitrotetrazol-2-yl)-4H-pyran-3-carbonitrile
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H10IN7O3
InChI InChI=1S/C14H10IN7O3/c1-7-12(21-19-14(18-20-21)22(23)24)11(10(6-16)13(17)25-7)8-3-2-4-9(15)5-8/h2-5,11H,17H2,1H3
InChIKey XKQSEQUQIUABHX-UHFFFAOYSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2006)
Molecular Weight 451.183 g/mol
Source File Reference MHKO7580