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BSTUJRNLGWRMKD-UHFFFAOYSA-N

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BSTUJRNLGWRMKD-UHFFFAOYSA-N
SpectraBase Compound ID IUnlgFDSbiH
InChI InChI=1S/C12H11N5O2S/c1-7-2-4-8(5-3-7)9-6-14-10-11(13)16-20(18,19)17-12(10)15-9/h2-6H,1H3,(H2,13,16)(H,15,17)
InChIKey BSTUJRNLGWRMKD-UHFFFAOYSA-N
Mol Weight 289.31 g/mol
Molecular Formula C12H11N5O2S
Exact Mass 289.063346 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4kYuzXuv6D2
Name BSTUJRNLGWRMKD-UHFFFAOYSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H11N5O2S
InChI InChI=1S/C12H11N5O2S/c1-7-2-4-8(5-3-7)9-6-14-10-11(13)16-20(18,19)17-12(10)15-9/h2-6H,1H3,(H2,13,16)(H,15,17)
InChIKey BSTUJRNLGWRMKD-UHFFFAOYSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2007)
Molecular Weight 289.312 g/mol
Source File Reference MHKO11884