| SpectraBase Spectrum ID |
8x7sWIAaJZM |
| Name |
T-Butyl (S)-3-hydroxy-3-(2-naphthyl)propanoate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
272.141244501 u |
| Formula |
C17H20O3 |
| InChI |
InChI=1S/C17H20O3/c1-17(2,3)20-16(19)11-15(18)14-9-8-12-6-4-5-7-13(12)10-14/h4-10,15,18H,11H2,1-3H3/t15-/m0/s1 |
| InChIKey |
PCAIYUFIHFVROJ-HNNXBMFYSA-N |
| SMILES |
C(C(OC(C)(C)C)=O)[C@@](C=1C=C2C=CC=CC2=CC1)(O)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.853883 |
