![2-Cyanomethyl-5,6,7,8-tetrahydrobenzo[b]thieno[2,3-d]oxazine-4-(3H)-one](/api/spectrum/EFJoUm1kH1J/structure.png?h=300&w=458 "2-Cyanomethyl-5,6,7,8-tetrahydrobenzo[b]thieno[2,3-d]oxazine-4-(3H)-one")
| SpectraBase Compound ID | 1fVEYGlGUks |
|---|---|
| InChI | InChI=1S/C12H10N2O2S/c13-6-5-9-14-11-10(12(15)16-9)7-3-1-2-4-8(7)17-11/h1-5H2 |
| InChIKey | CHYBWWJMYNEMRJ-UHFFFAOYSA-N |
| Mol Weight | 246.28 g/mol |
| Molecular Formula | C12H10N2O2S |
| Exact Mass | 246.046299 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | EFJoUm1kH1J |
|---|---|
| Name | 2-Cyanomethyl-5,6,7,8-tetrahydrobenzo[b]thieno[2,3-d]oxazine-4-(3H)-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H10N2O2S |
| InChI | InChI=1S/C12H10N2O2S/c13-6-5-9-14-11-10(12(15)16-9)7-3-1-2-4-8(7)17-11/h1-5H2 |
| InChIKey | CHYBWWJMYNEMRJ-UHFFFAOYSA-N |
| Molecular Weight | 246.284 g/mol |
| SMILES | c12c(C(=O)OC(=N2)CC#N)c2CCCCc2s1 |
| SPLASH | splash10-03fr-5930000000-e6dd17c4ec32b464a5f6 |
| Source of Spectrum | Y-50-769-4 |
| Synonyms | 3-Cyanomethyl-4,5,6,7,-tetrahydrobenzo[b]thiono[2,3-d]oxazine-4-(3H)-one 2-(4-oxo-5,6,7,8-tetrahydro-4H-benzo[4,5]thieno[2,3-d][1,3]oxazin-2-yl)acetonitrile 2-(4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d][1,3]oxazin-2-yl)acetonitrile 2-(4-oxo-5,6,7,8-tetrahydrobenzothiopheno[2,3-d][1,3]oxazin-2-yl)acetonitrile 2-(4-oxidanylidene-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d][1,3]oxazin-2-yl)ethanenitrile |
| Wiley ID | 1736719 |