SpectraBase Compound ID | 2orFtW9m6or |
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InChI | InChI=1S/C8H7NO2/c10-7-3-1-2-6-5(7)4-8(11)9-6/h1-3,10H,4H2,(H,9,11) |
InChIKey | FTJQLPXJRKHATE-UHFFFAOYSA-N |
Mol Weight | 149.15 g/mol |
Molecular Formula | C8H7NO2 |
Exact Mass | 149.047678 g/mol |
SpectraBase Spectrum ID | 2uPzS5gOCmy |
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Name | 2,3-Dihydroindole-4-ol-2-one |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 149.047678467 u |
Formula | C8H7NO2 |
InChI | InChI=1S/C8H7NO2/c10-7-3-1-2-6-5(7)4-8(11)9-6/h1-3,10H,4H2,(H,9,11) |
InChIKey | FTJQLPXJRKHATE-UHFFFAOYSA-N |
Molecular Weight | 149.149 g/mol |
SMILES | C1=CC=C2C(=C1O)CC(N2)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.868062 |