| SpectraBase Compound ID | 2TXvEn7Qru2 |
|---|---|
| InChI | InChI=1S/C11H9N3O4S/c1-2-18-11(15)10-9(12-19-13-10)7-4-3-5-8(6-7)14(16)17/h3-6H,2H2,1H3 |
| InChIKey | IOMNEBGBTGFLIU-UHFFFAOYSA-N |
| Mol Weight | 279.27 g/mol |
| Molecular Formula | C11H9N3O4S |
| Exact Mass | 279.031377 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3TWoXve8qyW |
|---|---|
| Name | Ethyl 4-(3-nitrophenyl)-1,2,5-thiadiazole-3-carboxylate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H9N3O4S |
| InChI | InChI=1S/C11H9N3O4S/c1-2-18-11(15)10-9(12-19-13-10)7-4-3-5-8(6-7)14(16)17/h3-6H,2H2,1H3 |
| InChIKey | IOMNEBGBTGFLIU-UHFFFAOYSA-N |
| Molecular Weight | 279.270 g/mol |
| SMILES | c1(c(nsn1)-c1cc(N(=O)=O)ccc1)C(=O)OCC |
| SPLASH | splash10-001i-0390000000-89e5adac572c95d6b547 |
| Source of Spectrum | H1-53-170-3 |
| Wiley ID | 817734 |