| SpectraBase Compound ID | 3bFzqDIg2j4 |
|---|---|
| InChI | InChI=1S/C14H16N2O2/c17-14-12-6-1-2-7-13(12)15-10-16(14)8-4-3-5-11-9-18-11/h1-2,6-7,10-11H,3-5,8-9H2 |
| InChIKey | BGIYJJMOLWAVPS-UHFFFAOYSA-N |
| Mol Weight | 244.29 g/mol |
| Molecular Formula | C14H16N2O2 |
| Exact Mass | 244.121178 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AT9iYfc7aUl |
|---|---|
| Name | 4(3H)-Quinazolinone, 3-(4-oxiranylbutyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 244.121177761 u |
| Formula | C14H16N2O2 |
| InChI | InChI=1S/C14H16N2O2/c17-14-12-6-1-2-7-13(12)15-10-16(14)8-4-3-5-11-9-18-11/h1-2,6-7,10-11H,3-5,8-9H2 |
| InChIKey | BGIYJJMOLWAVPS-UHFFFAOYSA-N |
| Molecular Weight | 244.294 g/mol |
| SMILES | C1OC1CCCCN1C=NC=2C(C1=O)=CC=CC2 |