| SpectraBase Spectrum ID |
6qSNiQAme2B |
| Name |
4-{[(3-cyano-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]methyl}benzoic acid |
| Author |
A.V.Yarkov, IPAC, Russia |
| Copyright |
Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI |
InChI=1S/C23H18N2O2S/c24-13-19-21(16-5-2-1-3-6-16)18-7-4-8-20(18)25-22(19)28-14-15-9-11-17(12-10-15)23(26)27/h1-3,5-6,9-12H,4,7-8,14H2,(H,26,27) |
| InChIKey |
JZDSMWSDBSCBGA-UHFFFAOYSA-N |
| NMR Offset |
15.449 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Origin |
1H_UBI-VK_18310_10553 |
| Owner |
Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc. |
| Sample State |
soluted |
| Solvent |
DMSO-d6 |
| Source File Reference |
VendorID: 132636; Labnumber: SHES1-195; VK_ID: VK-010557 |
| Temperature |
308 °C |
![4-{[(3-cyano-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]methyl}benzoic acid](/api/spectrum/6qSNiQAme2B/structure.png?h=300&w=458 "4-{[(3-cyano-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]methyl}benzoic acid")
