| SpectraBase Spectrum ID |
Hu4cPqSri3q |
| Name |
1-Bromo-2-(phenylethynyl)-4-methylbenzene |
| Comments |
Less than 3 mono-isotopic peaks; Note: The molecular formula of the structure shown is C15H11Br - which differs from the formula reported for the mass spectrum (C15H13Br) |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H13Br |
| InChI |
InChI=1S/C15H11Br/c1-12-7-10-15(16)14(11-12)9-8-13-5-3-2-4-6-13/h2-7,10-11H,1H3 |
| InChIKey |
VSGOSEUUTMKJCY-UHFFFAOYSA-N |
| Molecular Weight |
271.157 g/mol |
| SMILES |
c1(Br)c(cc(cc1)C)C#Cc1ccccc1 |
| SPLASH |
splash10-00di-0090000000-4979c743a5f9b3be1b15 |
| Source of Spectrum |
F-56-861-25 |
| Wiley ID |
855782 |
