| SpectraBase Spectrum ID |
1tWbrHTVXQM |
| Name |
1-Bromo-4-methylbenzene |
| Appearance |
White crystals |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
169.973113225 u |
| Formula |
C7H7Br |
| InChI |
InChI=1S/C7H7Br/c1-6-2-4-7(8)5-3-6/h2-5H,1H3 |
| InChIKey |
ZBTMRBYMKUEVEU-UHFFFAOYSA-N |
| Instrument Name |
Agilent 5977B |
| Ionization Type |
EI positive ion |
| Literature Reference DOI |
10.1002/chem.202103669 |
| Molecular Weight |
171.037 g/mol |
| Quality |
187 |
| SMILES |
C1(Br)=CC=C(C=C1)C |
| SPLASH |
splash10-006x-9700000000-0dbb4d713b0b1684a981 |
| Source of Spectrum |
QE-28-SM31-2f (DOI: 10.1002/chem.202103669) |
| Wiley ID |
1898358 |
