| SpectraBase Compound ID | 8Shvg17QCGq |
|---|---|
| InChI | InChI=1S/C13H18O/c1-2-6-12(7-3-1)8-4-9-13-10-5-11-14-13/h1-3,6-7,13H,4-5,8-11H2 |
| InChIKey | PBXKRPSGIACPQF-UHFFFAOYSA-N |
| Mol Weight | 190.29 g/mol |
| Molecular Formula | C13H18O |
| Exact Mass | 190.135765 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | JYKBq0b9KHZ |
|---|---|
| Name | Furan, tetrahydro-2-(3-phenylpropyl)- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 190.135765199 u |
| Formula | C13H18O |
| InChI | InChI=1S/C13H18O/c1-2-6-12(7-3-1)8-4-9-13-10-5-11-14-13/h1-3,6-7,13H,4-5,8-11H2 |
| InChIKey | PBXKRPSGIACPQF-UHFFFAOYSA-N |
| Molecular Weight | 190.286 g/mol |
| SMILES | C(C1OCCC1)CCC1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.833308 |