| SpectraBase Compound ID | GnoXv6JUL9H |
|---|---|
| InChI | InChI=1S/C12H16N3O3PS/c1-3-16-19(20,17-4-2)18-12-14-13-10-15(12)11-8-6-5-7-9-11/h5-10H,3-4H2,1-2H3 |
| InChIKey | NIPIRMULGUQBLZ-UHFFFAOYSA-N |
| Mol Weight | 313.31 g/mol |
| Molecular Formula | C12H16N3O3PS |
| Exact Mass | 313.065 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5lI6AzSbRtL |
|---|---|
| Name | Triazophos P986 |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 313.064999556 u |
| Formula | C12H16N3O3PS |
| InChI | InChI=1S/C12H16N3O3PS/c1-3-16-19(20,17-4-2)18-12-14-13-10-15(12)11-8-6-5-7-9-11/h5-10H,3-4H2,1-2H3 |
| InChIKey | NIPIRMULGUQBLZ-UHFFFAOYSA-N |
| Molecular Weight | 313.312 g/mol |
| SMILES | C=1(N2C=NN=C2OP(OCC)(OCC)=S)C=CC=CC1 |