| SpectraBase Compound ID | C1ZJzj62IFJ |
|---|---|
| InChI | InChI=1S/C7H10N2/c8-5-6-2-1-3-7(9)4-6/h1-4H,5,8-9H2 |
| InChIKey | ZDBWYUOUYNQZBM-UHFFFAOYSA-N |
| Mol Weight | 122.17 g/mol |
| Molecular Formula | C7H10N2 |
| Exact Mass | 122.084398 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 2XhQZ95VUQb |
|---|---|
| Name | (3-Aminobenzyl)amine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 122.084398330 u |
| Formula | C7H10N2 |
| InChI | InChI=1S/C7H10N2/c8-5-6-2-1-3-7(9)4-6/h1-4H,5,8-9H2 |
| InChIKey | ZDBWYUOUYNQZBM-UHFFFAOYSA-N |
| Molecular Weight | 122.171 g/mol |
| SMILES | C(N)C=1C=C(C=CC1)N |
| Spectrum/Structure Validation Score (Raman) | 0.961884 |