SpectraBase Compound ID | 6o5cK68raNf |
---|---|
InChI | InChI=1S/C21H15BrO/c22-20-13-11-18(12-14-20)17-7-9-19(10-8-17)21(23)15-6-16-4-2-1-3-5-16/h1-15H/b15-6- |
InChIKey | NTCBUXIQMLORSI-UUASQNMZSA-N |
Mol Weight | 363.25 g/mol |
Molecular Formula | C21H15BrO |
Exact Mass | 362.030628 g/mol |
SpectraBase Spectrum ID | EzOIknwBfhE |
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Name | Bromadiolone-A |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 362.030628102 u |
Formula | C21H15BrO |
InChI | InChI=1S/C21H15BrO/c22-20-13-11-18(12-14-20)17-7-9-19(10-8-17)21(23)15-6-16-4-2-1-3-5-16/h1-15H/b15-6- |
InChIKey | NTCBUXIQMLORSI-UUASQNMZSA-N |
Molecular Weight | 363.254 g/mol |
SMILES | C1(C2=CC=C(C=C2)Br)=CC=C(C(\C=C/C=2C=CC=CC2)=O)C=C1 |