| SpectraBase Spectrum ID |
3oGdlGV48sk |
| Name |
2-((3-(4-methoxyphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl)thio)acetonitrile |
| Copyright |
Copyright © 2022-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
429.151098165 u |
| Formula |
C25H23N3O2S |
| InChI |
InChI=1S/C25H23N3O2S/c1-30-19-10-8-18(9-11-19)28-23(29)21-22(27-24(28)31-15-14-26)20-7-3-2-6-17(20)16-25(21)12-4-5-13-25/h2-3,6-11H,4-5,12-13,15-16H2,1H3 |
| InChIKey |
QHPGLAARGSVSBV-UHFFFAOYSA-N |
| Molecular Weight |
429.538 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_447 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: ZI/7130672; Lab Number: AL-281/11337010 |
| Temperature |
29.85 °C |
![2-((3-(4-methoxyphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl)thio)acetonitrile](/api/spectrum/3oGdlGV48sk/structure.png?h=300&w=458 "2-((3-(4-methoxyphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl)thio)acetonitrile")
