| SpectraBase Compound ID | tWiYtmmcVo |
|---|---|
| InChI | InChI=1S/C9H13N/c1-2-9(10)8-6-4-3-5-7-8/h3-7,9H,2,10H2,1H3 |
| InChIKey | AQFLVLHRZFLDDV-UHFFFAOYSA-N |
| Mol Weight | 135.21 g/mol |
| Molecular Formula | C9H13N |
| Exact Mass | 135.104799 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 174mTjjUYLM |
|---|---|
| Name | 1-Phenylpropylamine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 135.104799423 u |
| Formula | C9H13N |
| InChI | InChI=1S/C9H13N/c1-2-9(10)8-6-4-3-5-7-8/h3-7,9H,2,10H2,1H3 |
| InChIKey | AQFLVLHRZFLDDV-UHFFFAOYSA-N |
| Molecular Weight | 135.210 g/mol |
| SMILES | C(N)(C=1C=CC=CC1)CC |
| Spectrum/Structure Validation Score (Raman) | 0.987246 |