| SpectraBase Compound ID | 3uLHpLEFfXN |
|---|---|
| InChI | InChI=1S/C12H16O2/c1-2-3-4-9-14-12-7-5-11(10-13)6-8-12/h2,5-8,13H,1,3-4,9-10H2 |
| InChIKey | PIBRDLFITUTWOI-UHFFFAOYSA-N |
| Mol Weight | 192.26 g/mol |
| Molecular Formula | C12H16O2 |
| Exact Mass | 192.11503 g/mol |
| SpectraBase Spectrum ID | 72lvNfd1jGr |
|---|---|
| Name | 4-(Pent-4-enyloxy)phenylmethanol |
| 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/c1-2-3-4-9-14-12-7-5-11(10-13)6-8-12/h2,5-8,13H,1,3-4,9-10H2 |
| InChIKey | PIBRDLFITUTWOI-UHFFFAOYSA-N |
| Molecular Weight | 192.258 g/mol |
| SMILES | C(=C)CCCOC=1C=CC(=CC1)CO |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.961104 |