| SpectraBase Spectrum ID |
2R64PlxEHNK |
| Name |
acetic acid, [[3-cyano-4-(3-cyclohexen-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl]thio]-, 1-methylethyl ester |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
356.155849193 u |
| Formula |
C20H24N2O2S |
| InChI |
InChI=1S/C20H24N2O2S/c1-13(2)24-18(23)12-25-20-16(11-21)19(14-7-4-3-5-8-14)15-9-6-10-17(15)22-20/h3-4,13-14H,5-10,12H2,1-2H3 |
| InChIKey |
BYJMITRGJOUKAS-UHFFFAOYSA-N |
| Molecular Weight |
356.484 g/mol |
| NMR Offset |
17.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_9226 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/9301763; Lab Info: DVD; Lab Number: DVD-0000083 |
![acetic acid, [[3-cyano-4-(3-cyclohexen-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl]thio]-, 1-methylethyl ester](/api/spectrum/2R64PlxEHNK/structure.png?h=300&w=458 "acetic acid, [[3-cyano-4-(3-cyclohexen-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl]thio]-, 1-methylethyl ester")
