| SpectraBase Spectrum ID |
4RcTJwkE2y |
| Name |
(5S,8aS)-5-((S)-1-Hydroxyhexyl)-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 |
C13H21NO3 |
| InChI |
InChI=1S/C13H21NO3/c1-2-3-4-8-12(15)11-7-5-6-10-9-17-13(16)14(10)11/h5-6,10-12,15H,2-4,7-9H2,1H3/t10-,11-,12-/m0/s1 |
| InChIKey |
QPZPCYFEOSZWLE-SRVKXCTJSA-N |
| Instrument Name |
HP 5989A or ThermoFisher Scientific DSQII |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/adsc.201900349 |
| Molecular Weight |
239.315 g/mol |
| Optical Rotation |
[a]D19 = +2.3 (c = 1, CHCl3) |
| Reported Formula |
C13H21NO3 |
| SMILES |
O[C@@](CCCCC)([C@]1(N2[C@@](C=CC1)(COC2=O)[H])[H])[H] |
| SPLASH |
splash10-000i-4900000000-cc3c4046c2e961552a7b |
| Source of Spectrum |
ASC-361-SM22-(S,S,S)-9a |
| Thin-Layer Chromatography |
Rf = 0.45 (hexanes/Et2O, 10:90) |
| Wiley ID |
1835288 |
![(5S,8aS)-5-((S)-1-Hydroxyhexyl)-1,5,6,8a-tetrahydro-3H-oxazolo[3,4-a]pyridin-3-one](/api/spectrum/4RcTJwkE2y/structure.png?h=300&w=458 "(5S,8aS)-5-((S)-1-Hydroxyhexyl)-1,5,6,8a-tetrahydro-3H-oxazolo[3,4-a]pyridin-3-one")
