| SpectraBase Compound ID | I8aezsfg5FC |
|---|---|
| InChI | InChI=1S/C15H23NO4/c1-6-13(17)16-10(2)9-11-7-8-12(18-3)15(20-5)14(11)19-4/h7-8,10H,6,9H2,1-5H3,(H,16,17) |
| InChIKey | LXWMHLHXGRYYAL-UHFFFAOYSA-N |
| Mol Weight | 281.35 g/mol |
| Molecular Formula | C15H23NO4 |
| Exact Mass | 281.162708 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | J7jBFWgbr1H |
|---|---|
| Name | 2,3,4-Trimethoxyamphetamine prop |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 281.162708221 u |
| Formula | C15H23NO4 |
| InChI | InChI=1S/C15H23NO4/c1-6-13(17)16-10(2)9-11-7-8-12(18-3)15(20-5)14(11)19-4/h7-8,10H,6,9H2,1-5H3,(H,16,17) |
| InChIKey | LXWMHLHXGRYYAL-UHFFFAOYSA-N |
| SMILES | C=1(C(=C(C(=CC1)OC)OC)OC)CC(NC(CC)=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.88967 |