SpectraBase Compound ID | 7mAPnrOsiZ1 |
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InChI | InChI=1S/C8H9N.ClH/c9-8-5-6-3-1-2-4-7(6)8;/h1-4,8H,5,9H2;1H |
InChIKey | DMXZQYQZYGGJTC-UHFFFAOYSA-N |
Mol Weight | 155.63 g/mol |
Molecular Formula | C8H10ClN |
Exact Mass | 155.050177 g/mol |
SpectraBase Spectrum ID | 9CxDik4k6q7 |
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Name | Bicyclo[4.2.0]octa-1,3,5-trien-7-amine, hydrochloride |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 155.050177026 u |
Formula | C8H10ClN |
InChI | InChI=1S/C8H9N.ClH/c9-8-5-6-3-1-2-4-7(6)8;/h1-4,8H,5,9H2;1H |
InChIKey | DMXZQYQZYGGJTC-UHFFFAOYSA-N |
SMILES | NC1CC=2C1=CC=CC2.Cl |
Spectrum/Structure Validation Score (Raman) | 0.913527 |