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TWNSCSKRVKTOJQ-UHFFFAOYSA-N

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TWNSCSKRVKTOJQ-UHFFFAOYSA-N
SpectraBase Compound ID HtI8rggAPpF
InChI InChI=1S/C9H9Cl3N4O2/c1-14-4-5(13-7(14)9(10,11)12)15(2)8(18)16(3)6(4)17/h1-3H3
InChIKey TWNSCSKRVKTOJQ-UHFFFAOYSA-N
Mol Weight 311.56 g/mol
Molecular Formula C9H9Cl3N4O2
Exact Mass 309.979109 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FqzSd6eSBRe
Name TWNSCSKRVKTOJQ-UHFFFAOYSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H9Cl3N4O2
InChI InChI=1S/C9H9Cl3N4O2/c1-14-4-5(13-7(14)9(10,11)12)15(2)8(18)16(3)6(4)17/h1-3H3
InChIKey TWNSCSKRVKTOJQ-UHFFFAOYSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2010)
Molecular Weight 311.555 g/mol
Source File Reference MHKO25948