| SpectraBase Compound ID | QPrB7gbD2Q |
|---|---|
| InChI | InChI=1S/C12H17NO/c1-13(2)12(14)10-6-9-11-7-4-3-5-8-11/h3-5,7-8H,6,9-10H2,1-2H3 |
| InChIKey | MEZFIXQKOPODHB-UHFFFAOYSA-N |
| Mol Weight | 191.27 g/mol |
| Molecular Formula | C12H17NO |
| Exact Mass | 191.131014 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | CZCZS8QoU5k |
|---|---|
| Name | N,N-Dimethyl-4-phenylbutanamide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 191.131014170 u |
| Formula | C12H17NO |
| InChI | InChI=1S/C12H17NO/c1-13(2)12(14)10-6-9-11-7-4-3-5-8-11/h3-5,7-8H,6,9-10H2,1-2H3 |
| InChIKey | MEZFIXQKOPODHB-UHFFFAOYSA-N |
| Molecular Weight | 191.274 g/mol |
| SMILES | C(N(C)C)(=O)CCCC=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.943869 |