SpectraBase Compound ID | BHNvPEpu1NH |
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InChI | InChI=1S/C13H9NO/c15-12-8-7-10-6-5-9-3-1-2-4-11(9)13(10)14-12/h1-8H,(H,14,15) |
InChIKey | UIWLITBBFICQKW-UHFFFAOYSA-N |
Mol Weight | 195.22 g/mol |
Molecular Formula | C13H9NO |
Exact Mass | 195.068414 g/mol |
SpectraBase Spectrum ID | DpA5Y24Y555 |
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Name | Benzo[H]quinolin-2(1H)-one |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 195.068413913 u |
Formula | C13H9NO |
InChI | InChI=1S/C13H9NO/c15-12-8-7-10-6-5-9-3-1-2-4-11(9)13(10)14-12/h1-8H,(H,14,15) |
InChIKey | UIWLITBBFICQKW-UHFFFAOYSA-N |
Molecular Weight | 195.221 g/mol |
SMILES | N1C=2C=3C=CC=CC3C=CC2C=CC1=O |
Spectrum/Structure Validation Score (Raman) | 0.830423 |