| SpectraBase Spectrum ID |
2gzvlHdIigL |
| Name |
(3S,7R,7aR)-7-(4-Chlorophenyl)-5-oxo-3-phenyl-2,3,5,6,7,7a-hexahydropyrrolo[2,1-b]oxazole |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
313.086956457 u |
| Formula |
C18H16ClNO2 |
| InChI |
InChI=1S/C18H16ClNO2/c19-14-8-6-12(7-9-14)15-10-17(21)20-16(11-22-18(15)20)13-4-2-1-3-5-13/h1-9,15-16,18H,10-11H2/t15-,16-,18-/m1/s1 |
| InChIKey |
YWDWUEJIOXLVFM-JFIYKMOQSA-N |
| Instrument Name |
Hewlett-Packard 5988A |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3998/ark.5550190.0004.a09 |
| Molecular Weight |
313.784 g/mol |
| Optical Rotation |
[a]D22 = +58 (c = 0.1, CH2Cl2) |
| Quality |
44 |
| SMILES |
[C@]12(N(C(C[C@@]2(C2=CC=C(C=C2)Cl)[H])=O)[C@](CO1)(C1=CC=CC=C1)[H])[H] |
| SPLASH |
splash10-000j-0900000000-d39eb4b1b56bf825072e |
| Source of Spectrum |
ARK-2003-77-7b (DOI: 10.3998/ark.5550190.0004.a09) |
| Wiley ID |
1899684 |
![(3S,7R,7aR)-7-(4-Chlorophenyl)-5-oxo-3-phenyl-2,3,5,6,7,7a-hexahydropyrrolo[2,1-b]oxazole](/api/spectrum/2gzvlHdIigL/structure.png?h=300&w=458 "(3S,7R,7aR)-7-(4-Chlorophenyl)-5-oxo-3-phenyl-2,3,5,6,7,7a-hexahydropyrrolo[2,1-b]oxazole")
