| SpectraBase Spectrum ID |
ByAY7R9uXOh |
| Name |
(5S,8aS)-5-((R)-hydroxy(phenyl)methyl)-1,5,6,8a-tetrahydro-3H-oxazolo[3,4-a]pyridin-3-one |
| Appearance |
Colourless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H15NO3 |
| InChI |
InChI=1S/C14H15NO3/c16-13(10-5-2-1-3-6-10)12-8-4-7-11-9-18-14(17)15(11)12/h1-7,11-13,16H,8-9H2/t11-,12-,13+/m0/s1 |
| InChIKey |
GVFVMVVIRWPCNG-RWMBFGLXSA-N |
| Instrument Name |
HP 5989A or ThermoFisher Scientific DSQII |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/adsc.201900349 |
| Molecular Weight |
245.278 g/mol |
| Optical Rotation |
[a]D19 = -23.9 (c = 1, CHCl3) |
| Reported Formula |
C14H15NO3 |
| SMILES |
O[C@](c1ccccc1)([C@]1(N2[C@@](C=CC1)(COC2=O)[H])[H])[H] |
| SPLASH |
splash10-00mx-9400000000-b0f81bb0185ed60961b1 |
| Source of Spectrum |
ASC-361-SM19-(R,S,S)-7a |
| Thin-Layer Chromatography |
Rf = 0.36 (hexanes/ethyl acetate, 50:50) |
| Wiley ID |
1835279 |
![(5S,8aS)-5-((R)-hydroxy(phenyl)methyl)-1,5,6,8a-tetrahydro-3H-oxazolo[3,4-a]pyridin-3-one](/api/spectrum/ByAY7R9uXOh/structure.png?h=300&w=458 "(5S,8aS)-5-((R)-hydroxy(phenyl)methyl)-1,5,6,8a-tetrahydro-3H-oxazolo[3,4-a]pyridin-3-one")
