| SpectraBase Compound ID | 2IDem2VEEo8 |
|---|---|
| InChI | InChI=1S/C11H15NO2/c1-2-9(12)5-8-3-4-10-11(6-8)14-7-13-10/h3-4,6,9H,2,5,7,12H2,1H3 |
| InChIKey | VHMRXGAIDDCGDU-UHFFFAOYSA-N |
| Mol Weight | 193.25 g/mol |
| Molecular Formula | C11H15NO2 |
| Exact Mass | 193.110279 g/mol |
Vapor Phase (Gas) Infrared Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | LsCCT5aveZL |
|---|---|
| Name | 3,4-Methylenedioxyphenyl-2-butanamine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 193.110278725 u |
| Formula | C11H15NO2 |
| InChI | InChI=1S/C11H15NO2/c1-2-9(12)5-8-3-4-10-11(6-8)14-7-13-10/h3-4,6,9H,2,5,7,12H2,1H3 |
| InChIKey | VHMRXGAIDDCGDU-UHFFFAOYSA-N |
| Molecular Weight | 193.246 g/mol |
| SMILES | NC(CC=1C=C2OCOC2=CC1)CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.965158 |