| SpectraBase Compound ID | KbQRCDpufET |
|---|---|
| InChI | InChI=1S/C13H16O2/c1-4-8-14-12-7-6-11(3)10-13(12)15-9-5-2/h4-7,10H,1-2,8-9H2,3H3 |
| InChIKey | XCQXMUDEBBRBMB-UHFFFAOYSA-N |
| Mol Weight | 204.27 g/mol |
| Molecular Formula | C13H16O2 |
| Exact Mass | 204.11503 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 2PFE5bpGhfX |
|---|---|
| Name | 1,2-bis(Allyloxy)-4-methylbenzene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 204.115029753 u |
| Formula | C13H16O2 |
| InChI | InChI=1S/C13H16O2/c1-4-8-14-12-7-6-11(3)10-13(12)15-9-5-2/h4-7,10H,1-2,8-9H2,3H3 |
| InChIKey | XCQXMUDEBBRBMB-UHFFFAOYSA-N |
| Molecular Weight | 204.269 g/mol |
| SMILES | C=1(C(=CC=C(C1)C)OCC=C)OCC=C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.962999 |