| SpectraBase Spectrum ID |
9A8iZMhOSZF |
| Name |
(R)-2-Bromo-4-(but-3-en-2-yl)-1-methylbenzene |
| Appearance |
Colorless oil |
| Carrier Gas |
Hydrogen |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
224.020063419 u |
| Formula |
C11H13Br |
| GC Oven Program |
Oven temp 300 oC |
| InChI |
InChI=1S/C11H13Br/c1-4-8(2)10-6-5-9(3)11(12)7-10/h4-8H,1H2,2-3H3/t8-/m1/s1 |
| InChIKey |
RJKHZIYZPJWZEH-MRVPVSSYSA-N |
| Instrument Name |
Agilent GC6890-HP 5973 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.202200058 |
| Molecular Weight |
225.129 g/mol |
| Optical Rotation |
[a]D20 = -22.5 (436 nm), -11.6 (546 nm), -10.1 (579 nm), -9.9 (589 nm) (1.0 g/100 ml in CHCl3) |
| Quality |
498 |
| SMILES |
C1=C(C=C(C(=C1)C)Br)[C@@](C=C)(C)[H] |
| SPLASH |
splash10-001j-1920000000-1d7fd56d18874f009917 |
| Source of Spectrum |
K1-2022-SM24-14 (DOI: 10.1002/ejoc.202200058) |
| Thin-Layer Chromatography |
0.7 (SiO2, pentane) |
| Wiley ID |
1898684 |
