![Carbamic acid, (3-butylhexahydrothieno[3,2-c]isoxazol-6-yl)-, methyl ester, [3R-(3.alpha.,3a.alpha.,6.alpha.,6a.alpha.)]-](/api/spectrum/9b2se0dRXkr/structure.png?h=300&w=458 "Carbamic acid, (3-butylhexahydrothieno[3,2-c]isoxazol-6-yl)-, methyl ester, [3R-(3.alpha.,3a.alpha.,6.alpha.,6a.alpha.)]-")
| SpectraBase Compound ID | LLWQbVvR6uj |
|---|---|
| InChI | InChI=1S/C11H20N2O3S/c1-3-4-5-8-10-9(13-16-8)7(6-17-10)12-11(14)15-2/h7-10,13H,3-6H2,1-2H3,(H,12,14)/t7-,8+,9+,10+/m0/s1 |
| InChIKey | UELXSVAVBORQFS-SGIHWFKDSA-N |
| Mol Weight | 260.35 g/mol |
| Molecular Formula | C11H20N2O3S |
| Exact Mass | 260.119464 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9b2se0dRXkr |
|---|---|
| Name | Carbamic acid, (3-butylhexahydrothieno[3,2-c]isoxazol-6-yl)-, methyl ester, [3R-(3.alpha.,3a.alpha.,6.alpha.,6a.alpha.)]- |
| Alternate Name(s) | Thieno[3,2-c]isoxazole, carbamic acid deriv. Methyl (3R,3aS,6R,6aR)-3-butylhexahydrothieno[3,2-c]isoxazol-6-ylcarbamate [3R-(3.alpha.,3a.alpha.,6.alpha.,6a.alpha.)]-3-butylhexahydrothieno-[3,2-c]isoxazol-6-yl carbamic acid methyl ester N-[(3R,3aS,6R,6aR)-3-butyl-1,3,3a,5,6,6a-hexahydrothieno[3,2-c]isoxazol-6-yl]carbamic acid methyl ester Methyl N-[(3R,3aS,6R,6aR)-3-butyl-1,3,3a,5,6,6a-hexahydrothieno[3,2-c]isoxazol-6-yl]carbamate Methyl N-[(3R,3aS,6R,6aR)-3-butyl-1,3,3a,5,6,6a-hexahydrothieno[3,2-c][1,2]oxazol-6-yl]carbamate |
| CAS Registry Number | 115587-48-9 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H20N2O3S |
| InChI | InChI=1S/C11H20N2O3S/c1-3-4-5-8-10-9(13-16-8)7(6-17-10)12-11(14)15-2/h7-10,13H,3-6H2,1-2H3,(H,12,14)/t7-,8+,9+,10+/m0/s1 |
| InChIKey | UELXSVAVBORQFS-SGIHWFKDSA-N |
| Molecular Weight | 260.352 g/mol |
| SMILES | N1O[C@@]([C@@]2([C@]1([C@](CS2)(NC(=O)OC)[H])[H])[H])(CCCC)[H] |
| SPLASH | splash10-0udi-0900000000-5a6d0a64dfd8fae2c5e3 |
| Source of Spectrum | F-43-4898-10 |
| Wiley ID | 1263263 |