| SpectraBase Spectrum ID |
1ZGvTg5f3te |
| Name |
1H-isoindol-1-one, 2-[(2-chlorophenyl)methyl]-3-[[4-[(hexahydro-1H-azepin-1-yl)sulfonyl]phenyl]amino]-2,3-dihydro- |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
509.153990645 u |
| Formula |
C27H28ClN3O3S |
| InChI |
InChI=1S/C27H28ClN3O3S/c28-25-12-6-3-9-20(25)19-31-26(23-10-4-5-11-24(23)27(31)32)29-21-13-15-22(16-14-21)35(33,34)30-17-7-1-2-8-18-30/h3-6,9-16,26,29H,1-2,7-8,17-19H2 |
| InChIKey |
FQANHKSELJZNCP-UHFFFAOYSA-N |
| Molecular Weight |
510.052 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2021_2934 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/12689613 |
![1H-isoindol-1-one, 2-[(2-chlorophenyl)methyl]-3-[[4-[(hexahydro-1H-azepin-1-yl)sulfonyl]phenyl]amino]-2,3-dihydro-](/api/spectrum/1ZGvTg5f3te/structure.png?h=300&w=458 "1H-isoindol-1-one, 2-[(2-chlorophenyl)methyl]-3-[[4-[(hexahydro-1H-azepin-1-yl)sulfonyl]phenyl]amino]-2,3-dihydro-")
