| SpectraBase Spectrum ID |
GUTTeFWRl0B |
| Name |
2-Bromanyl-5-tert-butyl-1,3-bis(1-methoxy-2-methyl-propan-2-yl)benzene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
384.166393301 u |
| Formula |
C20H33BrO2 |
| InChI |
InChI=1S/C20H33BrO2/c1-18(2,3)14-10-15(19(4,5)12-22-8)17(21)16(11-14)20(6,7)13-23-9/h10-11H,12-13H2,1-9H3 |
| InChIKey |
LQIZFQSCRVJRRD-UHFFFAOYSA-N |
| Molecular Weight |
385.386 g/mol |
| SMILES |
C=1(C(=C(C(COC)(C)C)C=C(C1)C(C)(C)C)Br)C(COC)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.978484 |
