| SpectraBase Spectrum ID |
2ainkQJHZCp |
| Name |
1-(2,6-dimethylphenyl)-3-({3-[2-(ethylsulfanyl)-1,3-benzothiazol-6-yl]-2-oxopropyl}sulfanyl)propan-2-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 |
445.095240513 u |
| Formula |
C21H23N3O2S3 |
| InChI |
InChI=1S/C21H23N3O2S3/c1-4-28-21-23-16-9-8-15(10-17(16)29-21)22-18(25)11-27-12-19(26)24-20-13(2)6-5-7-14(20)3/h5-10H,4,11-12H2,1-3H3,(H,22,25)(H,24,26) |
| InChIKey |
VOYJEVYHQIBXTC-UHFFFAOYSA-N |
| Molecular Weight |
445.614 g/mol |
| NMR Offset |
15.0036 |
| NMR Spectrometer Frequency |
250.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_325 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: ZI/7072654; Lab Info: LP; Lab Number: LP-0602606 |
| Temperature |
23.85 °C |
![1-(2,6-dimethylphenyl)-3-({3-[2-(ethylsulfanyl)-1,3-benzothiazol-6-yl]-2-oxopropyl}sulfanyl)propan-2-one](/api/spectrum/2ainkQJHZCp/structure.png?h=300&w=458 "1-(2,6-dimethylphenyl)-3-({3-[2-(ethylsulfanyl)-1,3-benzothiazol-6-yl]-2-oxopropyl}sulfanyl)propan-2-one")
