![2-(butylsulfanyl)-5-cyclopentyl-5,6-dihydrobenzo[h]quinazolin-4(3H)-one](/api/spectrum/DugZ6bi8cN2/structure.png?h=300&w=458 "2-(butylsulfanyl)-5-cyclopentyl-5,6-dihydrobenzo[h]quinazolin-4(3H)-one")
| SpectraBase Compound ID | 4nErgV0RdEb |
|---|---|
| InChI | InChI=1S/C21H26N2OS/c1-2-3-12-25-21-22-19-16-11-7-6-10-15(16)13-17(14-8-4-5-9-14)18(19)20(24)23-21/h6-7,10-11,14,17H,2-5,8-9,12-13H2,1H3,(H,22,23,24) |
| InChIKey | HCBYMXRNQWBYOW-UHFFFAOYSA-N |
| Mol Weight | 354.51 g/mol |
| Molecular Formula | C21H26N2OS |
| Exact Mass | 354.176585 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | DugZ6bi8cN2 |
|---|---|
| Name | 2-(butylsulfanyl)-5-cyclopentyl-5,6-dihydrobenzo[h]quinazolin-4(3H)-one |
| Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 354.176584638 u |
| Formula | C21H26N2OS |
| InChI | InChI=1S/C21H26N2OS/c1-2-3-12-25-21-22-19-16-11-7-6-10-15(16)13-17(14-8-4-5-9-14)18(19)20(24)23-21/h6-7,10-11,14,17H,2-5,8-9,12-13H2,1H3,(H,22,23,24) |
| InChIKey | HCBYMXRNQWBYOW-UHFFFAOYSA-N |
| Molecular Weight | 354.512 g/mol |
| NMR Offset | 18.0068 |
| NMR Spectrometer Frequency | 500.134 |
| Observed nucleus | 1H |
| Sample State | Soluted |
| Sample_ID | 1H_CB_2020_2099 |
| Solvent | DMSO-d6 |
| Source | Vendor ID: NMR/12278893 |