| SpectraBase Compound ID | 3mIZpJjxVK2 |
|---|---|
| InChI | InChI=1S/C12H17N/c1-12(2)9-13(3)11(12)10-7-5-4-6-8-10/h4-8,11H,9H2,1-3H3 |
| InChIKey | WLVWNPNOSQINKC-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 | 1GRbIoccRTW |
|---|---|
| Name | Azetidine, 1,3,3-trimethyl-2-phenyl- |
| 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/c1-12(2)9-13(3)11(12)10-7-5-4-6-8-10/h4-8,11H,9H2,1-3H3 |
| InChIKey | WLVWNPNOSQINKC-UHFFFAOYSA-N |
| Molecular Weight | 175.275 g/mol |
| SMILES | C1(C)(C)C(N(C1)C)C1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.851612 |