![trans-3-(4-Methoxyphenyl)-2-thia-5-aza-6-oxatricyclo[5.3.1.0(4,11)]undec-4-ene](/api/spectrum/1VVDt3z6D8z/structure.png?h=300&w=458 "trans-3-(4-Methoxyphenyl)-2-thia-5-aza-6-oxatricyclo[5.3.1.0(4,11)]undec-4-ene")
| SpectraBase Compound ID | IVRlPutfbVg |
|---|---|
| InChI | InChI=1S/C15H17NO2S/c1-17-10-7-5-9(6-8-10)15-14-13-11(18-16-14)3-2-4-12(13)19-15/h5-8,11-13,15H,2-4H2,1H3/t11-,12+,13-,15+/m1/s1 |
| InChIKey | FLEMOOKHURKYML-COMQUAJESA-N |
| Mol Weight | 275.37 g/mol |
| Molecular Formula | C15H17NO2S |
| Exact Mass | 275.098 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1VVDt3z6D8z |
|---|---|
| Name | trans-3-(4-Methoxyphenyl)-2-thia-5-aza-6-oxatricyclo[5.3.1.0(4,11)]undec-4-ene |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H17NO2S |
| InChI | InChI=1S/C15H17NO2S/c1-17-10-7-5-9(6-8-10)15-14-13-11(18-16-14)3-2-4-12(13)19-15/h5-8,11-13,15H,2-4H2,1H3/t11-,12+,13-,15+/m1/s1 |
| InChIKey | FLEMOOKHURKYML-COMQUAJESA-N |
| Molecular Weight | 275.366 g/mol |
| SMILES | C12=NO[C@]3([C@@]2([C@@](CCC3)([H])S[C@]1(c1ccc(cc1)OC)[H])[H])[H] |
| SPLASH | splash10-0ufr-0790000000-450c9afe42cc285b37a3 |
| Source of Spectrum | F-55-12507-10 |
| Synonyms | (3S,4aS,7aR,7bR)-3-(4-methoxyphenyl)-4a,5,6,7,7a,7b-hexahydro-3H-thieno[4,3,2-cd][1,2]benzisoxazole 4-[(3S,4aS,7aR,7bR)-4a,5,6,7,7a,7b-hexahydro-3H-thieno[4,3,2-cd][1,2]benzisoxazol-3-yl]phenyl methyl ether |
| Wiley ID | 839662 |