| SpectraBase Spectrum ID |
D3spi8n4JsA |
| Name |
benzo[b]thiophene-3-carbonitrile, 2-[[(E)-[5-(2,3-dimethyl-4-nitrophenyl)-2-furanyl]methylidene]amino]-4,5,6,7-tetrahydro- |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
405.114712655 u |
| Formula |
C22H19N3O3S |
| InChI |
InChI=1S/C22H19N3O3S/c1-13-14(2)19(25(26)27)9-8-16(13)20-10-7-15(28-20)12-24-22-18(11-23)17-5-3-4-6-21(17)29-22/h7-10,12H,3-6H2,1-2H3/b24-12+ |
| InChIKey |
MFPMDDPHTPLZAA-WYMPLXKRSA-N |
| Molecular Weight |
405.472 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_584 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: ZI/7048933; Lab Info: SAD; Lab Number: SAD-E300236 |
| Temperature |
29.85 °C |
![benzo[b]thiophene-3-carbonitrile, 2-[[(E)-[5-(2,3-dimethyl-4-nitrophenyl)-2-furanyl]methylidene]amino]-4,5,6,7-tetrahydro-](/api/spectrum/D3spi8n4JsA/structure.png?h=300&w=458 "benzo[b]thiophene-3-carbonitrile, 2-[[(E)-[5-(2,3-dimethyl-4-nitrophenyl)-2-furanyl]methylidene]amino]-4,5,6,7-tetrahydro-")
