| SpectraBase Spectrum ID |
IMfoV5JV2eJ |
| Name |
2-Tert-butoxy-1-phenyl-3-buten-1-ol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
220.146329882 u |
| Formula |
C14H20O2 |
| InChI |
InChI=1S/C14H20O2/c1-5-12(16-14(2,3)4)13(15)11-9-7-6-8-10-11/h5-10,12-13,15H,1H2,2-4H3 |
| InChIKey |
OGPURCHSAHNGMP-UHFFFAOYSA-N |
| Molecular Weight |
220.312 g/mol |
| SMILES |
C(OC(C)(C)C)(C(C1=CC=CC=C1)O)C=C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.929622 |
