| SpectraBase Spectrum ID |
qLfO52C6Mg |
| Name |
1-[2-chloro-5-(methylsulfanyl)phenyl]-2-{spiro[1,3-benzodioxole-2,1'-cyclohexan]-6-yl}ethan-1-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 |
389.085242379 u |
| Formula |
C20H20ClNO3S |
| InChI |
InChI=1S/C20H20ClNO3S/c1-26-14-6-7-16(21)15(12-14)19(23)22-13-5-8-17-18(11-13)25-20(24-17)9-3-2-4-10-20/h5-8,11-12H,2-4,9-10H2,1H3,(H,22,23) |
| InChIKey |
NCDXVKKVTAKXKF-UHFFFAOYSA-N |
| Molecular Weight |
389.897 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_5888 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/9322764; Lab Info: LP; Lab Number: LP-2191735 |
![1-[2-chloro-5-(methylsulfanyl)phenyl]-2-{spiro[1,3-benzodioxole-2,1'-cyclohexan]-6-yl}ethan-1-one](/api/spectrum/qLfO52C6Mg/structure.png?h=300&w=458 "1-[2-chloro-5-(methylsulfanyl)phenyl]-2-{spiro[1,3-benzodioxole-2,1'-cyclohexan]-6-yl}ethan-1-one")
