| SpectraBase Compound ID | 3nKBT66RtUb |
|---|---|
| InChI | InChI=1S/C9H12N6/c1-3-15(4-2-10-1)9-7-8(12-5-11-7)13-6-14-9/h5-6,10H,1-4H2,(H,11,12,13,14) |
| InChIKey | FFNVVVLETZYYJN-UHFFFAOYSA-N |
| Mol Weight | 204.24 g/mol |
| Molecular Formula | C9H12N6 |
| Exact Mass | 204.112344 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BS9OGQl70A7 |
|---|---|
| Name | 1-(7H-Purin-6-yl)piperazine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 204.112344410 u |
| Formula | C9H12N6 |
| InChI | InChI=1S/C9H12N6/c1-3-15(4-2-10-1)9-7-8(12-5-11-7)13-6-14-9/h5-6,10H,1-4H2,(H,11,12,13,14) |
| InChIKey | FFNVVVLETZYYJN-UHFFFAOYSA-N |
| Molecular Weight | 204.237 g/mol |
| SMILES | C12=C(N=CN2)N=CN=C1N1CCNCC1 |