| SpectraBase Compound ID | 6NmCmG8x4ZY |
|---|---|
| InChI | InChI=1S/C8H8N2O/c11-8-6-3-1-2-4-7(6)9-5-10-8/h1-4,9H,5H2,(H,10,11) |
| InChIKey | XWWYZFUBBJHKSP-UHFFFAOYSA-N |
| Mol Weight | 148.16 g/mol |
| Molecular Formula | C8H8N2O |
| Exact Mass | 148.063663 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 4R29tLhiLfu |
|---|---|
| Name | 2,3-Dihydro-4(1H)-quinazolinone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 148.063662885 u |
| Formula | C8H8N2O |
| InChI | InChI=1S/C8H8N2O/c11-8-6-3-1-2-4-7(6)9-5-10-8/h1-4,9H,5H2,(H,10,11) |
| InChIKey | XWWYZFUBBJHKSP-UHFFFAOYSA-N |
| SMILES | N1C(C=2C=CC=CC2NC1)=O |
| Spectrum/Structure Validation Score (Raman) | 0.92643 |