| SpectraBase Compound ID | BIEXXnaciwe |
|---|---|
| InChI | InChI=1S/C14H23N/c1-11(15-5)10-12-6-8-13(9-7-12)14(2,3)4/h6-9,11,15H,10H2,1-5H3 |
| InChIKey | FJMRPGMPHQWPRI-UHFFFAOYSA-N |
| Mol Weight | 205.34 g/mol |
| Molecular Formula | C14H23N |
| Exact Mass | 205.18305 g/mol |
| SpectraBase Spectrum ID | KmAgrM9VwU8 |
|---|---|
| Name | 4-Tert-butylmethamphetamine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 205.183049745 u |
| Formula | C14H23N |
| InChI | InChI=1S/C14H23N/c1-11(15-5)10-12-6-8-13(9-7-12)14(2,3)4/h6-9,11,15H,10H2,1-5H3 |
| InChIKey | FJMRPGMPHQWPRI-UHFFFAOYSA-N |
| Molecular Weight | 205.345 g/mol |
| SMILES | CNC(C)CC1=CC=C(C=C1)C(C)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.973235 |