| SpectraBase Spectrum ID |
BBq4Flm25P9 |
| Name |
Benzenemethanol, .alpha.-(bromomethyl)-.alpha.-[[(1,1,2-trimethyl-2-propen-1-yl)oxy]methyl]- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
312.072492914 u |
| Formula |
C15H21BrO2 |
| InChI |
InChI=1S/C15H21BrO2/c1-12(2)14(3,4)18-11-15(17,10-16)13-8-6-5-7-9-13/h5-9,17H,1,10-11H2,2-4H3 |
| InChIKey |
KZYWPQSLQVBADF-UHFFFAOYSA-N |
| Molecular Weight |
313.235 g/mol |
| SMILES |
C=C(C(OCC(CBr)(O)C1=CC=CC=C1)(C)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.89628 |
![Benzenemethanol, .alpha.-(bromomethyl)-.alpha.-[[(1,1,2-trimethyl-2-propen-1-yl)oxy]methyl]-](/api/spectrum/BBq4Flm25P9/structure.png?h=300&w=458 "Benzenemethanol, .alpha.-(bromomethyl)-.alpha.-[[(1,1,2-trimethyl-2-propen-1-yl)oxy]methyl]-")
