| SpectraBase Spectrum ID |
36XXBHvemVc |
| Name |
cycloocta[b]thiophene-3-carboxylic acid, 2-[(3,5-dinitrobenzoyl)amino]-4,5,6,7,8,9-hexahydro-, methyl 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 |
433.094371131 u |
| Formula |
C19H19N3O7S |
| InChI |
InChI=1S/C19H19N3O7S/c1-29-19(24)16-14-6-4-2-3-5-7-15(14)30-18(16)20-17(23)11-8-12(21(25)26)10-13(9-11)22(27)28/h8-10H,2-7H2,1H3,(H,20,23) |
| InChIKey |
HBLURSCOOLEIOV-UHFFFAOYSA-N |
| Molecular Weight |
433.435 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_1493 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/8307076; Lab Info: XXX; Lab Number: ZIU/0028923 |
![cycloocta[b]thiophene-3-carboxylic acid, 2-[(3,5-dinitrobenzoyl)amino]-4,5,6,7,8,9-hexahydro-, methyl ester](/api/spectrum/36XXBHvemVc/structure.png?h=300&w=458 "cycloocta[b]thiophene-3-carboxylic acid, 2-[(3,5-dinitrobenzoyl)amino]-4,5,6,7,8,9-hexahydro-, methyl ester")
