| SpectraBase Spectrum ID |
Bs7eA5HaEGG |
| Name |
(5S,6R)-2-sec-Butyl-2-hydroxy-4,5-dimethyl-6-phenylmorpholin-3-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
277.167793602 u |
| Formula |
C16H23NO3 |
| InChI |
InChI=1S/C16H23NO3/c1-5-11(2)16(19)15(18)17(4)12(3)14(20-16)13-9-7-6-8-10-13/h6-12,14,19H,5H2,1-4H3/t11?,12-,14-,16?/m0/s1 |
| InChIKey |
FUGVZZDGKMZFOB-LZPVFFGRSA-N |
| SMILES |
C1(C(N(C)[C@]([C@](O1)(C=1C=CC=CC1)[H])(C)[H])=O)(C(CC)C)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.85163 |