| SpectraBase Compound ID | AAadFTonJf3 |
|---|---|
| InChI | InChI=1S/C10H11Br/c1-7-5-6-8-3-2-4-9(8)10(7)11/h5-6H,2-4H2,1H3 |
| InChIKey | NSDRWYDHESDIJM-UHFFFAOYSA-N |
| Mol Weight | 211.1 g/mol |
| Molecular Formula | C10H11Br |
| Exact Mass | 210.004413 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | KzixcILZXGj |
|---|---|
| Name | 4-Bromo-5-methylindan |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 210.004413354 u |
| Formula | C10H11Br |
| InChI | InChI=1S/C10H11Br/c1-7-5-6-8-3-2-4-9(8)10(7)11/h5-6H,2-4H2,1H3 |
| InChIKey | NSDRWYDHESDIJM-UHFFFAOYSA-N |
| Molecular Weight | 211.102 g/mol |
| SMILES | C=1(C2=C(CCC2)C=CC1C)Br |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.929399 |