| SpectraBase Compound ID | LZLqBP3CLpT |
|---|---|
| InChI | InChI=1S/C12H17NO2/c1-3-4-9-15-12-7-5-11(6-8-12)13-10(2)14/h5-8H,3-4,9H2,1-2H3,(H,13,14) |
| InChIKey | JYMFGHFNWSMPBP-UHFFFAOYSA-N |
| Mol Weight | 207.27 g/mol |
| Molecular Formula | C12H17NO2 |
| Exact Mass | 207.125929 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 3d8kkKXanWj |
|---|---|
| Name | 4'-Butoxyacetanilide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 207.125928789 u |
| Formula | C12H17NO2 |
| InChI | InChI=1S/C12H17NO2/c1-3-4-9-15-12-7-5-11(6-8-12)13-10(2)14/h5-8H,3-4,9H2,1-2H3,(H,13,14) |
| InChIKey | JYMFGHFNWSMPBP-UHFFFAOYSA-N |
| Molecular Weight | 207.273 g/mol |
| SMILES | N(C1=CC=C(C=C1)OCCCC)C(C)=O |
| Spectrum/Structure Validation Score (Raman) | 0.959538 |