| SpectraBase Spectrum ID |
773Uv82vGXL |
| Name |
5-Thienoyl-3-[(3-methylamino)prop-1-yl)]-1,2-oxazole |
| Comments |
Less than 3 mono-isotopic peaks; Note: The molecular formula of the structure shown is C12H14ClN2O6S - which differs from the formula reported for the mass spectrum (C12H15ClN2O6S) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H15ClN2O6S |
| InChI |
InChI=1S/C12H14N2O2S.ClHO4/c1-13-6-2-4-10-9(8-16-14-10)12(15)11-5-3-7-17-11;2-1(3,4)5/h3,5,7-8,13H,2,4,6H2,1H3;1H/q;-4 |
| InChIKey |
IEQFEYZGSHKIPT-UHFFFAOYSA-N |
| Molecular Weight |
349.765 g/mol |
| SMILES |
[Cl]([O-])([O-])([O-])[O-].N(CCCc1nocc1C(c1sccc1)=O)C |
| SPLASH |
splash10-0006-9000000000-7ec3790ad2f6eb0f4d57 |
| Source of Spectrum |
H1-38-1337-10 |
| Synonyms |
4-Thienoyl-3-[(3-methylamino)prop-1-yl)]-1,2-oxazole |
| Wiley ID |
756411 |
![5-Thienoyl-3-[(3-methylamino)prop-1-yl)]-1,2-oxazole](/api/spectrum/773Uv82vGXL/structure.png?h=300&w=458 "5-Thienoyl-3-[(3-methylamino)prop-1-yl)]-1,2-oxazole")
