| SpectraBase Compound ID | BMrUU9zzH5A |
|---|---|
| InChI | InChI=1S/C12H17N/c13-10-12(8-4-5-9-12)11-6-2-1-3-7-11/h1-3,6-7H,4-5,8-10,13H2 |
| InChIKey | SJWOFBVBNFLWLP-UHFFFAOYSA-N |
| Mol Weight | 175.27 g/mol |
| Molecular Formula | C12H17N |
| Exact Mass | 175.1361 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | HU8pPDzIX57 |
|---|---|
| Name | (1-Phenylcyclopentyl)methanamine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 175.136099551 u |
| Formula | C12H17N |
| InChI | InChI=1S/C12H17N/c13-10-12(8-4-5-9-12)11-6-2-1-3-7-11/h1-3,6-7H,4-5,8-10,13H2 |
| InChIKey | SJWOFBVBNFLWLP-UHFFFAOYSA-N |
| Molecular Weight | 175.275 g/mol |
| SMILES | C(N)C1(CCCC1)C1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.919714 |