| SpectraBase Compound ID | DXk0Kl30EwL |
|---|---|
| InChI | InChI=1S/C10H11NO2/c1-13-6-2-3-7-8(4-6)9(11)5-10(7)12/h2-4,9H,5,11H2,1H3 |
| InChIKey | BSVCBXUGLVHQLU-UHFFFAOYSA-N |
| Mol Weight | 177.2 g/mol |
| Molecular Formula | C10H11NO2 |
| Exact Mass | 177.078979 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 | 6Z7cKdAAiuA |
|---|---|
| Name | 3-Amino-5-methoxy-indan-1-one |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 177.078978596 u |
| Formula | C10H11NO2 |
| InChI | InChI=1S/C10H11NO2/c1-13-6-2-3-7-8(4-6)9(11)5-10(7)12/h2-4,9H,5,11H2,1H3 |
| InChIKey | BSVCBXUGLVHQLU-UHFFFAOYSA-N |
| Molecular Weight | 177.203 g/mol |
| SMILES | C12=C(C(=O)CC2N)C=CC(=C1)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.867662 |