![1-(Tert-butylamino)-2-methyl-1-oxopropan-2-yl 2-([4-oxo-6-propyl-1,4-dihydropyrimidin-2-yl]thio)acetate](/api/spectrum/Aax7Z4WuIzR/structure.png?h=300&w=458 "1-(Tert-butylamino)-2-methyl-1-oxopropan-2-yl 2-([4-oxo-6-propyl-1,4-dihydropyrimidin-2-yl]thio)acetate")
| SpectraBase Compound ID | DjgkRsIttTO |
|---|---|
| InChI | InChI=1S/C17H27N3O4S/c1-7-8-11-9-12(21)19-15(18-11)25-10-13(22)24-17(5,6)14(23)20-16(2,3)4/h9H,7-8,10H2,1-6H3,(H,20,23)(H,18,19,21) |
| InChIKey | VRSURENZIMISDP-UHFFFAOYSA-N |
| Mol Weight | 369.48 g/mol |
| Molecular Formula | C17H27N3O4S |
| Exact Mass | 369.172228 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Aax7Z4WuIzR |
|---|---|
| Name | 1-(Tert-butylamino)-2-methyl-1-oxopropan-2-yl 2-([4-oxo-6-propyl-1,4-dihydropyrimidin-2-yl]thio)acetate |
| Appearance | White powder |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C17H27N3O4S |
| InChI | InChI=1S/C17H27N3O4S/c1-7-8-11-9-12(21)19-15(18-11)25-10-13(22)24-17(5,6)14(23)20-16(2,3)4/h9H,7-8,10H2,1-6H3,(H,20,23)(H,18,19,21) |
| InChIKey | VRSURENZIMISDP-UHFFFAOYSA-N |
| Instrument Name | Finnigan MAT-8430 |
| Ionization Type | EI |
| Literature Reference DOI | 10.1002/jccs.201800209 |
| Molecular Weight | 369.480 g/mol |
| SMILES | N1C(SCC(OC(C(=O)NC(C)(C)C)(C)C)=O)=NC(=O)C=C1CCC |
| SPLASH | splash10-08n9-4950000000-21f61a12445cd09f71b8 |
| Source of Spectrum | QA-66-1378-5e |
| Wiley ID | 1838599 |