SpectraBase Compound ID | AYQ6CpMJcGf |
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InChI | InChI=1S/C8H5Br/c1-2-7-3-5-8(9)6-4-7/h1,3-6H |
InChIKey | LTLVZQZDXQWLHU-UHFFFAOYSA-N |
Mol Weight | 181.03 g/mol |
Molecular Formula | C8H5Br |
Exact Mass | 179.957463 g/mol |
SpectraBase Spectrum ID | 9QCYZJoYwUY |
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Name | 1-Bromo-4-ethynylbenzene |
Source of Sample | Sigma-Aldrich Co. LLC. |
Catalog Number | 206512 |
CAS Registry Number | 766-96-1 |
Copyright | Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C8H5Br |
InChI | InChI=1S/C8H5Br/c1-2-7-3-5-8(9)6-4-7/h1,3-6H |
InChIKey | LTLVZQZDXQWLHU-UHFFFAOYSA-N |
Observed nucleus | 13C |
Purity | 97% |
Solvent | CDCl3 |
Source of Spectrum | Sigma-Aldrich Co. LLC. |
Wiley ID | SIAL_13CNMR_002939 |