| SpectraBase Spectrum ID |
GkxgZY86xJ8 |
| Name |
((4S,5S)-2-{[(2E)-3,7-dimethyl-2,6-octadienyl]sulfanyl}-5-phenyl-4,5-dihydro-1,3-oxazol-4-yl)methyl pivalate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
429.233765162 u |
| Formula |
C25H35NO3S |
| InChI |
InChI=1S/C25H35NO3S/c1-18(2)11-10-12-19(3)15-16-30-24-26-21(17-28-23(27)25(4,5)6)22(29-24)20-13-8-7-9-14-20/h7-9,11,13-15,21-22H,10,12,16-17H2,1-6H3/b19-15+/t21-,22-/m0/s1 |
| InChIKey |
XOUKONPKEWXRJX-QHRLOLLYSA-N |
| Molecular Weight |
429.619 g/mol |
| SMILES |
C1(=N[C@]([C@@](O1)(C1=CC=CC=C1)[H])(COC(C(C)(C)C)=O)[H])SC\C=C\(CCC=C(C)C)C |
![((4S,5S)-2-{[(2E)-3,7-dimethyl-2,6-octadienyl]sulfanyl}-5-phenyl-4,5-dihydro-1,3-oxazol-4-yl)methyl pivalate](/api/spectrum/GkxgZY86xJ8/structure.png?h=300&w=458 "((4S,5S)-2-{[(2E)-3,7-dimethyl-2,6-octadienyl]sulfanyl}-5-phenyl-4,5-dihydro-1,3-oxazol-4-yl)methyl pivalate")
