| SpectraBase Spectrum ID |
EnkREbOcKI2 |
| Name |
(5S)-3-oxo-5,6-bis(Phenylmethoxy)hexanoic acid (phenylmethyl) ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
432.193673997 u |
| Formula |
C27H28O5 |
| InChI |
InChI=1S/C27H28O5/c28-25(17-27(29)32-20-24-14-8-3-9-15-24)16-26(31-19-23-12-6-2-7-13-23)21-30-18-22-10-4-1-5-11-22/h1-15,26H,16-21H2/t26-/m0/s1 |
| InChIKey |
AOFQXVDYOJMESA-SANMLTNESA-N |
| Molecular Weight |
432.516 g/mol |
| SMILES |
C(CC(C[C@@](COCC=1C=CC=CC1)(OCC=1C=CC=CC1)[H])=O)(=O)OCC=1C=CC=CC1 |
