SpectraBase Spectrum ID |
ISWbJQNFIm3 |
Name |
2H-1-benzopyran-3-carboxylic acid, 6-bromo-2-oxo-, 4-acetylphenyl 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 |
385.978986449 u |
Formula |
C18H11BrO5 |
InChI |
InChI=1S/C18H11BrO5/c1-10(20)11-2-5-14(6-3-11)23-17(21)15-9-12-8-13(19)4-7-16(12)24-18(15)22/h2-9H,1H3 |
InChIKey |
URJSJFNKBJZFTE-UHFFFAOYSA-N |
Molecular Weight |
387.185 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_13716 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: ZI/10026673; Lab Info: PLU; Lab Number: FCI-479-2231 |