| SpectraBase Compound ID | 7pB2BviHW01 |
|---|---|
| InChI | InChI=1S/C13H22O3S/c1-9-6-5-7-11-10(9)8-12(13(2,3)4)16-17(11,14)15/h6,10-12H,5,7-8H2,1-4H3/t10-,11-,12+/m1/s1 |
| InChIKey | UMMRWQAWGUXFDB-UTUOFQBUSA-N |
| Mol Weight | 258.38 g/mol |
| Molecular Formula | C13H22O3S |
| Exact Mass | 258.128966 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | CGW4cehVlvf |
|---|---|
| Name | (1R*,2R*,2'S*)-2-(3,3-Dimethylbutyl)-3-methyl-3-cyclohexene-1,2'-sultone |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H22O3S |
| InChI | InChI=1S/C13H22O3S/c1-9-6-5-7-11-10(9)8-12(13(2,3)4)16-17(11,14)15/h6,10-12H,5,7-8H2,1-4H3/t10-,11-,12+/m1/s1 |
| InChIKey | UMMRWQAWGUXFDB-UTUOFQBUSA-N |
| Molecular Weight | 258.376 g/mol |
| SMILES | [C@]1(OS([C@]2([C@](C1)(C(=CCC2)C)[H])[H])(=O)=O)(C(C)(C)C)[H] |
| SPLASH | splash10-052f-9500000000-b23a57d95d1592604562 |
| Source of Spectrum | F-51-724-10 |
| Synonyms | (3S,4aR,8aR)-3-tert-butyl-5-methyl-3,4,4a,7,8,8a-hexahydro-2,1-benzoxathiin 1,1-dioxide (3S,4aR,8aR)-3-tert-butyl-5-methyl-3,4,4a,7,8,8a-hexahydro-2,1-benzoxathiine 1,1-dioxide (3S,4aR,8aR)-3-tert-Butyl-5-methyl-3,4,4a,7,8,8a-hexahydro-benzo[c][1,2]oxathiine 1,1-dioxide (3S,4aR,8aR)-3-tert-butyl-5-methyl-3,4,4a,7,8,8a-hexahydro-2,1$l^{6}-benzoxathiine 1,1-dioxide |
| Wiley ID | 790586 |