![ETHYL-[N-(3-NITROBENZO-[B]-THIOPHEN-2-YL)-N-PROPYLAMINO]-ACETATE](/api/spectrum/E1SSs3LgtM8/structure.png?h=300&w=458 "ETHYL-[N-(3-NITROBENZO-[B]-THIOPHEN-2-YL)-N-PROPYLAMINO]-ACETATE")
| SpectraBase Compound ID | BTVs0KV6MsB |
|---|---|
| InChI | InChI=1S/C15H18N2O4S/c1-3-9-16(10-13(18)21-4-2)15-14(17(19)20)11-7-5-6-8-12(11)22-15/h5-8H,3-4,9-10H2,1-2H3 |
| InChIKey | KDOBONUMLUNTPL-UHFFFAOYSA-N |
| Mol Weight | 322.38 g/mol |
| Molecular Formula | C15H18N2O4S |
| Exact Mass | 322.098728 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | E1SSs3LgtM8 |
|---|---|
| Name | ETHYL-[N-(3-NITROBENZO-[B]-THIOPHEN-2-YL)-N-PROPYLAMINO]-ACETATE |
| Compound Number | 4D |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI | InChI=1S/C15H18N2O4S/c1-3-9-16(10-13(18)21-4-2)15-14(17(19)20)11-7-5-6-8-12(11)22-15/h5-8H,3-4,9-10H2,1-2H3 |
| InChIKey | KDOBONUMLUNTPL-UHFFFAOYSA-N |
| Literature Reference | F.GUERRERA,L.SALERNO,L.LAMARTINA,D.SPINELLI J.CHEM.SOC.PERKIN-1,1243(1995) |
| Solvent | Dimethyl sulfoxide-d6 |