| SpectraBase Spectrum ID |
3TUOMDHMcrd |
| Name |
3-methyl-2-(phenethylthio)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-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 |
402.176584638 u |
| Formula |
C25H26N2OS |
| InChI |
InChI=1S/C25H26N2OS/c1-27-23(28)21-22(26-24(27)29-16-13-18-9-3-2-4-10-18)20-12-6-5-11-19(20)17-25(21)14-7-8-15-25/h2-6,9-12H,7-8,13-17H2,1H3 |
| InChIKey |
HXNWIOIJTCQNRT-UHFFFAOYSA-N |
| Molecular Weight |
402.556 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_448 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: ZI/7130678; Lab Number: AL-281/11337016 |
| Temperature |
29.85 °C |
![3-methyl-2-(phenethylthio)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one](/api/spectrum/3TUOMDHMcrd/structure.png?h=300&w=458 "3-methyl-2-(phenethylthio)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one")
