| SpectraBase Spectrum ID |
CI5FWZ3S2LZ |
| Name |
phenol, 2,6-dibromo-4-(4-morpholinylcarbonothioyl)-, 2,4-dinitrobenzoate (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 |
572.884096938 u |
| Formula |
C18H13Br2N3O7S |
| InChI |
InChI=1S/C18H13Br2N3O7S/c19-13-7-10(17(31)21-3-5-29-6-4-21)8-14(20)16(13)30-18(24)12-2-1-11(22(25)26)9-15(12)23(27)28/h1-2,7-9H,3-6H2 |
| InChIKey |
MWMFTSXZXXNQME-UHFFFAOYSA-N |
| Molecular Weight |
575.184 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_229 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: ZI/7057094; Lab Info: LD; Lab Number: LD-5000277 |
| Temperature |
29.85 °C |
