| SpectraBase Compound ID | 3zqn79nepFZ |
|---|---|
| InChI | InChI=1S/C6H8N2O2S/c1-4(9)3-5-7-8(2)6(11)10-5/h3H2,1-2H3 |
| InChIKey | KQIGURHYUPFCQR-UHFFFAOYSA-N |
| Mol Weight | 172.2 g/mol |
| Molecular Formula | C6H8N2O2S |
| Exact Mass | 172.030649 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5vIoQ0wWfIB |
|---|---|
| Name | KQIGURHYUPFCQR-UHFFFAOYSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C6H8N2O2S |
| InChI | InChI=1S/C6H8N2O2S/c1-4(9)3-5-7-8(2)6(11)10-5/h3H2,1-2H3 |
| InChIKey | KQIGURHYUPFCQR-UHFFFAOYSA-N |
| Literature Reference Author | ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ |
| Literature Reference Citation | UNI_MAINZ,INTERNAL_DB(2007) |
| Molecular Weight | 172.202 g/mol |
| Source File Reference | MHKO13532 |