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KIRHSGGIMMTVPT-UHFFFAOYSA-N

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KIRHSGGIMMTVPT-UHFFFAOYSA-N
SpectraBase Compound ID GiwjGXRNdH6
InChI InChI=1S/C9H8N2O4S/c10-9(13)7-8(12)5-3-1-2-4-6(5)16(14,15)11-7/h1-4,11-12H,(H2,10,13)
InChIKey KIRHSGGIMMTVPT-UHFFFAOYSA-N
Mol Weight 240.23 g/mol
Molecular Formula C9H8N2O4S
Exact Mass 240.020478 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FY36kzmltsa
Name KIRHSGGIMMTVPT-UHFFFAOYSA-N
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H8N2O4S
InChI InChI=1S/C9H8N2O4S/c10-9(13)7-8(12)5-3-1-2-4-6(5)16(14,15)11-7/h1-4,11-12H,(H2,10,13)
InChIKey KIRHSGGIMMTVPT-UHFFFAOYSA-N
Literature Reference Author C.B.SCHAPIRA,I.A.PERILLO
Literature Reference Citation J.HETCYCL.CHEM.,30,1051(1993)
Literature Reference DOI 10.1002/jhet.5570300436
Molecular Weight 240.234 g/mol
Solvent CDCl3
Source File Reference UWGE1295