| SpectraBase Compound ID | EbmvmJHQOUf |
|---|---|
| InChI | InChI=1S/C12H14BrNO2/c13-11-3-1-2-10(8-11)12(15)9-14-4-6-16-7-5-14/h1-3,8H,4-7,9H2 |
| InChIKey | QXTHWCAYTFZYMG-UHFFFAOYSA-N |
| Mol Weight | 284.15 g/mol |
| Molecular Formula | C12H14BrNO2 |
| Exact Mass | 283.020792 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 2ZM6Pow0w23 |
|---|---|
| Name | 1-(3-Bromophenyl)-2-morpholinoethanone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 283.020791693 u |
| Formula | C12H14BrNO2 |
| InChI | InChI=1S/C12H14BrNO2/c13-11-3-1-2-10(8-11)12(15)9-14-4-6-16-7-5-14/h1-3,8H,4-7,9H2 |
| InChIKey | QXTHWCAYTFZYMG-UHFFFAOYSA-N |
| SMILES | C=1(C(CN2CCOCC2)=O)C=C(C=CC1)Br |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.842335 |