| SpectraBase Compound ID | 2zgGF18wKQZ |
|---|---|
| InChI | InChI=1S/C8H10BrNO/c9-4-2-6-10-5-1-3-8(10)7-11/h1,3,5,7H,2,4,6H2 |
| InChIKey | ORBADKMQLCCBBQ-UHFFFAOYSA-N |
| Mol Weight | 216.08 g/mol |
| Molecular Formula | C8H10BrNO |
| Exact Mass | 214.994577 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3UhcWkrT2yy |
|---|---|
| Name | 1-(3-Bromopropyl)-1H-2-pyrrolecarbaldehyde |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 214.994576945 u |
| Formula | C8H10BrNO |
| InChI | InChI=1S/C8H10BrNO/c9-4-2-6-10-5-1-3-8(10)7-11/h1,3,5,7H,2,4,6H2 |
| InChIKey | ORBADKMQLCCBBQ-UHFFFAOYSA-N |
| Molecular Weight | 216.078 g/mol |
| SMILES | C=1(N(C=CC1)CCCBr)C=O |