| SpectraBase Compound ID | Jl7DmdiGLL8 |
|---|---|
| InChI | InChI=1S/C14H23NO/c1-4-5-9-15-10-8-13-6-7-14(16-3)12(2)11-13/h6-7,11,15H,4-5,8-10H2,1-3H3 |
| InChIKey | UXBPQPQYYNYNQI-UHFFFAOYSA-N |
| Mol Weight | 221.34 g/mol |
| Molecular Formula | C14H23NO |
| Exact Mass | 221.177964 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | Jo4iFwikyAT |
|---|---|
| Name | 3-me-4-meo-pea bu |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 221.177964364 u |
| Formula | C14H23NO |
| InChI | InChI=1S/C14H23NO/c1-4-5-9-15-10-8-13-6-7-14(16-3)12(2)11-13/h6-7,11,15H,4-5,8-10H2,1-3H3 |
| InChIKey | UXBPQPQYYNYNQI-UHFFFAOYSA-N |
| Molecular Weight | 221.344 g/mol |
| SMILES | C=1(C(=CC(=CC1)CCNCCCC)C)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.985075 |