| SpectraBase Spectrum ID |
5vSCS8MUjse |
| Name |
Benzene, 2-(2-bromoethoxy)-1,3,5-trimethyl-; phenetole, beta-bromo-2,4,6-trimethyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
242.030628102 u |
| Formula |
C11H15BrO |
| InChI |
InChI=1S/C11H15BrO/c1-8-6-9(2)11(10(3)7-8)13-5-4-12/h6-7H,4-5H2,1-3H3 |
| InChIKey |
MHEDTCAIWFGREU-UHFFFAOYSA-N |
| Molecular Weight |
243.144 g/mol |
| SMILES |
C1(=C(C=C(C=C1C)C)C)OCCBr |
| Spectrum/Structure Validation Score (Raman) |
0.981991 |