![[(6-Purinyl)thio]acetic acid, hydrazide](/api/spectrum/LQwivMjlBuI/structure.png?h=300&w=458 "[(6-Purinyl)thio]acetic acid, hydrazide")
| SpectraBase Compound ID | 3AXr367ClSN |
|---|---|
| InChI | InChI=1S/C7H8N6OS/c8-13-4(14)1-15-7-5-6(10-2-9-5)11-3-12-7/h2-3H,1,8H2,(H,13,14)(H,9,10,11,12) |
| InChIKey | HYSYTVDBONGUGM-UHFFFAOYSA-N |
| Mol Weight | 224.24 g/mol |
| Molecular Formula | C7H8N6OS |
| Exact Mass | 224.04803 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LQwivMjlBuI |
|---|---|
| Name | [(6-Purinyl)thio]acetic acid, hydrazide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 224.048030075 u |
| Formula | C7H8N6OS |
| InChI | InChI=1S/C7H8N6OS/c8-13-4(14)1-15-7-5-6(10-2-9-5)11-3-12-7/h2-3H,1,8H2,(H,13,14)(H,9,10,11,12) |
| InChIKey | HYSYTVDBONGUGM-UHFFFAOYSA-N |
| Molecular Weight | 224.242 g/mol |
| SMILES | N1C=2C(SCC(NN)=O)=NC=NC2N=C1 |