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HFJLBTHKJSATQQ-UHFFFAOYSA-N

View entire compound with spectra: 2 NMR

HFJLBTHKJSATQQ-UHFFFAOYSA-N
SpectraBase Compound ID 2QMT4M8ihmE
InChI InChI=1S/C9H8N4O3S/c1-4(8(15)16)13-7(14)5-6(12-9(13)17)11-3-2-10-5/h2-4H,1H3,(H,15,16)(H,11,12,17)
InChIKey HFJLBTHKJSATQQ-UHFFFAOYSA-N
Mol Weight 252.25 g/mol
Molecular Formula C9H8N4O3S
Exact Mass 252.031711 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GMeYu1m03DP
Name HFJLBTHKJSATQQ-UHFFFAOYSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H8N4O3S
InChI InChI=1S/C9H8N4O3S/c1-4(8(15)16)13-7(14)5-6(12-9(13)17)11-3-2-10-5/h2-4H,1H3,(H,15,16)(H,11,12,17)
InChIKey HFJLBTHKJSATQQ-UHFFFAOYSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2007)
Molecular Weight 252.248 g/mol
Source File Reference MHKO15325