SpectraBase Compound ID | 9ZTW7ruIYfa |
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InChI | InChI=1S/C8H5BrClN5O2/c9-5-1-3-6(4-2-5)14-8(11-12-13-14)7(10)15(16)17/h1-4,7H |
InChIKey | DMYHVAKYTQRTAO-UHFFFAOYSA-N |
Mol Weight | 318.52 g/mol |
Molecular Formula | C8H5BrClN5O2 |
Exact Mass | 316.931515 g/mol |
SpectraBase Spectrum ID | 9JIxhzXNTcS |
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Name | 5-[Chloro(nitro)methyl]-1-(4-bromophenyl)-1H-tetrazole |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C8H5BrClN5O2 |
InChI | InChI=1S/C8H5BrClN5O2/c9-5-1-3-6(4-2-5)14-8(11-12-13-14)7(10)15(16)17/h1-4,7H |
InChIKey | DMYHVAKYTQRTAO-UHFFFAOYSA-N |
Molecular Weight | 318.518 g/mol |
SMILES | c1([n](nnn1)-c1ccc(cc1)Br)C(N(=O)=O)Cl |
SPLASH | splash10-0a4i-0920000000-20cb0df7efccfbbc1639 |
Source of Spectrum | F4-44-891-15 |
Wiley ID | 1706899 |