| SpectraBase Compound ID | EVQJYdfzBCd |
|---|---|
| InChI | InChI=1S/C12H17N/c1-10-5-2-3-6-11(10)9-12-7-4-8-13-12/h2-3,5-6,12-13H,4,7-9H2,1H3 |
| InChIKey | AEVCYCAGTSOXAE-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 | 4n0nk01eW3s |
|---|---|
| Name | 2-(2-Methylbenzyl)pyrrolidine |
| 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/c1-10-5-2-3-6-11(10)9-12-7-4-8-13-12/h2-3,5-6,12-13H,4,7-9H2,1H3 |
| InChIKey | AEVCYCAGTSOXAE-UHFFFAOYSA-N |
| Molecular Weight | 175.275 g/mol |
| SMILES | C1(NCCC1)CC1=C(C=CC=C1)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.935532 |