| SpectraBase Compound ID | H9n3O0KXop7 |
|---|---|
| InChI | InChI=1S/C11H12N2S/c1-3-10-12-9-7-5-4-6-8(9)11(13-10)14-2/h4-7H,3H2,1-2H3/i3D |
| InChIKey | NMDPYKKHHWRMOF-WFVSFCRTSA-N |
| Mol Weight | 205.3 g/mol |
| Molecular Formula | C11H112DN2S |
| Exact Mass | 205.078396 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 46fWkIHWMpZ |
|---|---|
| Name | 2-(1-Deuterioethyl)-4-(methylthio)quinazoline |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H11DN2S |
| InChI | InChI=1S/C11H12N2S/c1-3-10-12-9-7-5-4-6-8(9)11(13-10)14-2/h4-7H,3H2,1-2H3/i3D |
| InChIKey | NMDPYKKHHWRMOF-WFVSFCRTSA-N |
| Molecular Weight | 205.297 g/mol |
| SMILES | c1(nc2ccccc2c(n1)SC)C(C)[2D] |
| SPLASH | splash10-0pdi-4890000000-58b57dd0988a7f5a7830 |
| Source of Spectrum | F4-0-2957-24 |
| Wiley ID | 1618932 |