| SpectraBase Spectrum ID |
3aIqVEORiWO |
| Name |
2H-1,4-Benzoxazine-3-carbonitrile, 3,4-dihydro-4-[(4-methylphenyl)sulfonyl]- |
| CAS Registry Number |
111854-26-3 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H14N2O3S |
| InChI |
InChI=1S/C16H14N2O3S/c1-12-6-8-14(9-7-12)22(19,20)18-13(10-17)11-21-16-5-3-2-4-15(16)18/h2-9,13H,11H2,1H3 |
| InChIKey |
JQWPSOPXURMLJW-UHFFFAOYSA-N |
| Molecular Weight |
314.359 g/mol |
| SMILES |
c12N(S(c3ccc(cc3)C)(=O)=O)C(COc1cccc2)C#N |
| SPLASH |
splash10-0a4i-0901000000-39c766a569011a177148 |
| Source of Spectrum |
AH-118-276-8 |
| Synonyms |
3,4-Dihydro-4-tosyl-2H-1,4-benzoxazine-3-carbonitrile
4-[(4-methylphenyl)sulfonyl]-3,4-dihydro-2H-1,4-benzoxazine-3-carbonitrile |
| Wiley ID |
1314858 |
![2H-1,4-Benzoxazine-3-carbonitrile, 3,4-dihydro-4-[(4-methylphenyl)sulfonyl]-](/api/spectrum/3aIqVEORiWO/structure.png?h=300&w=458 "2H-1,4-Benzoxazine-3-carbonitrile, 3,4-dihydro-4-[(4-methylphenyl)sulfonyl]-")
