| SpectraBase Spectrum ID |
27ErtpBqb2 |
| Name |
3a,4-trans-3a,6a-cis-3-(4-methylphenyl)-3a,5,6,6a-tetrahydro-4H-cyclopenta[d]isoxazole-4-ol |
| Alternate Name(s) |
(3aS,4S,6aR)-3-(4-methylphenyl)-4,5,6,6a-tetrahydro-3aH-cyclopenta[d]isoxazol-4-ol
(3aS,4S,6aR)-3-p-Tolyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[d]isoxazol-4-ol
3a,4-cis-3a,6a-cis-3-(4-methylphenyl)-3a,5,6,6a-tetrahydro-4H-cyclopenta[d]isoxazole-4-ol |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H15NO2 |
| InChI |
InChI=1S/C13H15NO2/c1-8-2-4-9(5-3-8)13-12-10(15)6-7-11(12)16-14-13/h2-5,10-12,15H,6-7H2,1H3/t10-,11+,12-/m0/s1 |
| InChIKey |
JPHJKJCZRYXGSE-TUAOUCFPSA-N |
| Molecular Weight |
217.268 g/mol |
| SMILES |
O[C@@]1([C@@]2(C(=NO[C@@]2(CC1)[H])c1ccc(cc1)C)[H])[H] |
| SPLASH |
splash10-08fr-0900000000-bdfbb8c62d80a004e7ca |
| Source of Spectrum |
QB-20-123-2 |
| Wiley ID |
842192 |
![3a,4-trans-3a,6a-cis-3-(4-methylphenyl)-3a,5,6,6a-tetrahydro-4H-cyclopenta[d]isoxazole-4-ol](/api/spectrum/27ErtpBqb2/structure.png?h=300&w=458 "3a,4-trans-3a,6a-cis-3-(4-methylphenyl)-3a,5,6,6a-tetrahydro-4H-cyclopenta[d]isoxazole-4-ol")
