| SpectraBase Spectrum ID |
AdRcHiWsm5U |
| Name |
(2R,3S,7ar)-3-Methyl-7A-phenethyl-2-phenyl-2,3,6,7-tetrahydropyrrolo[2,1-B]oxazol-5-one |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
321.172878983 u |
| Formula |
C21H23NO2 |
| InChI |
InChI=1S/C21H23NO2/c1-16-20(18-10-6-3-7-11-18)24-21(15-13-19(23)22(16)21)14-12-17-8-4-2-5-9-17/h2-11,16,20H,12-15H2,1H3/t16-,20-,21+/m0/s1 |
| InChIKey |
PBBGVVVKIGIHJN-ORYQWCPZSA-N |
| Molecular Weight |
321.420 g/mol |
| SMILES |
[C@]12(O[C@@]([C@@](N2C(CC1)=O)(C)[H])(C=1C=CC=CC1)[H])CCC=1C=CC=CC1 |
![(2R,3S,7aR)-3-methyl-7a-phenethyl-2-phenyl-2,3,6,7-tetrahydropyrrolo[2,1-b]oxazol-5-one](/api/spectrum/AdRcHiWsm5U/structure.png?h=300&w=458 "(2R,3S,7aR)-3-methyl-7a-phenethyl-2-phenyl-2,3,6,7-tetrahydropyrrolo[2,1-b]oxazol-5-one")
