![Methyl 2-[3-(2-benzothiazolyl)-2-triazeno]benzoate](/api/spectrum/dpY1k0S3vs/structure.png?h=300&w=458 "Methyl 2-[3-(2-benzothiazolyl)-2-triazeno]benzoate")
| SpectraBase Compound ID | 8cdtUdgdjNH |
|---|---|
| InChI | InChI=1S/C15H12N4O2S/c1-21-14(20)10-6-2-3-7-11(10)17-19-18-15-16-12-8-4-5-9-13(12)22-15/h2-9H,1H3,(H,16,17,18) |
| InChIKey | LSWMWIPKMDUHFI-UHFFFAOYSA-N |
| Mol Weight | 312.35 g/mol |
| Molecular Formula | C15H12N4O2S |
| Exact Mass | 312.068097 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | dpY1k0S3vs |
|---|---|
| Name | Methyl 2-[3-(2-benzothiazolyl)-2-triazeno]benzoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 312.068096814 u |
| Formula | C15H12N4O2S |
| InChI | InChI=1S/C15H12N4O2S/c1-21-14(20)10-6-2-3-7-11(10)17-19-18-15-16-12-8-4-5-9-13(12)22-15/h2-9H,1H3,(H,16,17,18) |
| InChIKey | LSWMWIPKMDUHFI-UHFFFAOYSA-N |
| Molecular Weight | 312.347 g/mol |
| SMILES | C1(=NC2=CC=CC=C2S1)\N=N\NC=1C(C(OC)=O)=CC=CC1 |