| SpectraBase Compound ID | GF4ei4gWuqd |
|---|---|
| InChI | InChI=1S/C8H13NO/c1-6-4-5-7(2)9(6)8(3)10/h4-7H,1-3H3 |
| InChIKey | WAZNJGNPEXBHCB-UHFFFAOYSA-N |
| Mol Weight | 139.2 g/mol |
| Molecular Formula | C8H13NO |
| Exact Mass | 139.099714 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | DhdJifpgHSx |
|---|---|
| Name | 1-(2,5-Dimethyl-2,5-dihydropyrrol-1-yl)ethanone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 139.099714042 u |
| Formula | C8H13NO |
| InChI | InChI=1S/C8H13NO/c1-6-4-5-7(2)9(6)8(3)10/h4-7H,1-3H3 |
| InChIKey | WAZNJGNPEXBHCB-UHFFFAOYSA-N |
| Molecular Weight | 139.198 g/mol |
| SMILES | C(N1C(C=CC1C)C)(=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.975142 |