| SpectraBase Spectrum ID |
AeNvvT42XGr |
| Name |
(3R,7S,7aS)-7-Ethyl-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 |
231.125928789 u |
| Formula |
C14H17NO2 |
| InChI |
InChI=1S/C14H17NO2/c1-2-10-8-13(16)15-12(9-17-14(10)15)11-6-4-3-5-7-11/h3-7,10,12,14H,2,8-9H2,1H3/t10-,12-,14-/m0/s1 |
| InChIKey |
XSZDJCXTNWSDSL-JKOKRWQUSA-N |
| Instrument Name |
Hewlett-Packard 5988A |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3998/ark.5550190.0004.a09 |
| Molecular Weight |
231.295 g/mol |
| Optical Rotation |
[a]D22 = -125 (c = 1.0, CH2Cl2) |
| Quality |
65 |
| SMILES |
C1(N2[C@]([C@](C1)(CC)[H])(OC[C@]2(C1=CC=CC=C1)[H])[H])=O |
| SPLASH |
splash10-0uxr-0980000000-0ad6e4b36cebf35b4c49 |
| Source of Spectrum |
ARK-2003-78-8a (DOI: 10.3998/ark.5550190.0004.a09) |
| Wiley ID |
1899685 |
![(3R,7S,7aS)-7-Ethyl-5-oxo-3-phenyl-2,3,5,6,7,7a-hexahydropyrrolo[2,1-b]oxazole](/api/spectrum/AeNvvT42XGr/structure.png?h=300&w=458 "(3R,7S,7aS)-7-Ethyl-5-oxo-3-phenyl-2,3,5,6,7,7a-hexahydropyrrolo[2,1-b]oxazole")
