| SpectraBase Compound ID | xbFfohOYi1 |
|---|---|
| InChI | InChI=1S/C13H19NO/c1-13(2,3)11-8-6-10(7-9-11)12(15)14(4)5/h6-9H,1-5H3 |
| InChIKey | CBIBDXNRXPFAAU-UHFFFAOYSA-N |
| Mol Weight | 205.3 g/mol |
| Molecular Formula | C13H19NO |
| Exact Mass | 205.146664 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 8fjMoJnht15 |
|---|---|
| Name | 4-Tert.-butyl-N,N-dimethylbenzamide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 205.146664235 u |
| Formula | C13H19NO |
| InChI | InChI=1S/C13H19NO/c1-13(2,3)11-8-6-10(7-9-11)12(15)14(4)5/h6-9H,1-5H3 |
| InChIKey | CBIBDXNRXPFAAU-UHFFFAOYSA-N |
| Molecular Weight | 205.301 g/mol |
| SMILES | CN(C)C(=O)C1=CC=C(C=C1)C(C)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.907498 |