| SpectraBase Compound ID | Fcsr2XG5xhp |
|---|---|
| InChI | InChI=1S/C13H15NO/c1-4-9-13(3)11-7-5-6-8-12(11)14-10(2)15-13/h4-8H,1,9H2,2-3H3 |
| InChIKey | XWPMAENPKWDGDT-UHFFFAOYSA-N |
| Mol Weight | 201.27 g/mol |
| Molecular Formula | C13H15NO |
| Exact Mass | 201.115364 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 31liGrSntdx |
|---|---|
| Name | 8-Allyl-2,8-dimethyl-benzoxazine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 201.115364106 u |
| Formula | C13H15NO |
| InChI | InChI=1S/C13H15NO/c1-4-9-13(3)11-7-5-6-8-12(11)14-10(2)15-13/h4-8H,1,9H2,2-3H3 |
| InChIKey | XWPMAENPKWDGDT-UHFFFAOYSA-N |
| Molecular Weight | 201.269 g/mol |
| SMILES | C1(=NC=2C(C(O1)(CC=C)C)=CC=CC2)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.871654 |