| SpectraBase Spectrum ID |
GUaC2ZISJhY |
| Name |
1-benzenebutanoic acid, beta~1~,4-dibromo-alpha~1~-[(methyloxidanyl)oxidanylidenemethyl]-gamma~1~-oxo-, 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 |
405.905149481 u |
| Formula |
C13H12Br2O5 |
| InChI |
InChI=1S/C13H12Br2O5/c1-19-12(17)9(13(18)20-2)10(15)11(16)7-3-5-8(14)6-4-7/h3-6,9-10H,1-2H3 |
| InChIKey |
DUKHBPHBYGEKKA-UHFFFAOYSA-N |
| Molecular Weight |
408.042 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_11324 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10261287; Lab Info: GEI; Lab Number: GEI-SHEP116 |
| Temperature |
23.85 °C |
![1-benzenebutanoic acid, beta~1~,4-dibromo-alpha~1~-[(methyloxidanyl)oxidanylidenemethyl]-gamma~1~-oxo-, methyl ester](/api/spectrum/GUaC2ZISJhY/structure.png?h=300&w=458 "1-benzenebutanoic acid, beta~1~,4-dibromo-alpha~1~-[(methyloxidanyl)oxidanylidenemethyl]-gamma~1~-oxo-, methyl ester")
