| SpectraBase Spectrum ID |
Km3Vk3DONIc |
| Name |
2-Hydroxy-1,2,2-triphenylethyl (1'R,3S)-3-hydroxyhexanoate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
404.198759378 u |
| Formula |
C26H28O4 |
| InChI |
InChI=1S/C26H28O4/c1-2-12-22(27)24(28)26(29)30-25(21-17-10-5-11-18-21)23(19-13-6-3-7-14-19)20-15-8-4-9-16-20/h3-11,13-18,22-25,27-28H,2,12H2,1H3/t22-,24?,25-/m0/s1 |
| InChIKey |
PRGJSNKJXZTWOA-HSPGVUBUSA-N |
| Molecular Weight |
404.506 g/mol |
| SMILES |
C(O[C@](C(C1=CC=CC=C1)C1=CC=CC=C1)(C=1C=CC=CC1)[H])(C([C@@](O)(CCC)[H])O)=O |
