| SpectraBase Spectrum ID |
IIjR5DFGKni |
| Name |
(3S)-5-Benzoxypent-1-en-3-ol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
192.115029753 u |
| Formula |
C12H16O2 |
| InChI |
InChI=1S/C12H16O2/c1-2-12(13)8-9-14-10-11-6-4-3-5-7-11/h2-7,12-13H,1,8-10H2/t12-/m1/s1 |
| InChIKey |
FSYFPYIMEHWSTG-GFCCVEGCSA-N |
| Molecular Weight |
192.258 g/mol |
| SMILES |
C(=C)[C@](CCOCC=1C=CC=CC1)(O)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.827299 |
