| SpectraBase Spectrum ID |
8kO5yIhr4DR |
| Name |
(3R)-3-{[(3'S)-3'-(benzyloxy)butanoyl]oxy}butanoic acidtert-butylester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
336.193673997 u |
| Formula |
C19H28O5 |
| InChI |
InChI=1S/C19H28O5/c1-14(22-13-16-9-7-6-8-10-16)11-17(20)23-15(2)12-18(21)24-19(3,4)5/h6-10,14-15H,11-13H2,1-5H3/t14-,15+/m0/s1 |
| InChIKey |
BETXCVGYCGXEKX-LSDHHAIUSA-N |
| Molecular Weight |
336.428 g/mol |
| SMILES |
C(=O)(OC(C)(C)C)C[C@@](C)(OC(C[C@](C)(OCC=1C=CC=CC1)[H])=O)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.939206 |
![(3R)-3-{[(3'S)-3'-(benzyloxy)butanoyl]oxy}butanoic acidtert-butylester](/api/spectrum/8kO5yIhr4DR/structure.png?h=300&w=458 "(3R)-3-{[(3'S)-3'-(benzyloxy)butanoyl]oxy}butanoic acidtert-butylester")
