| SpectraBase Spectrum ID |
2U3PkfJ8NSv |
| Name |
1-(Bromomethyl)-4-[3'-methoxy-3'-(methoxymethyl)butyl]benzene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
300.072492914 u |
| Formula |
C14H21BrO2 |
| InChI |
InChI=1S/C14H21BrO2/c1-14(17-3,11-16-2)9-8-12-4-6-13(10-15)7-5-12/h4-7H,8-11H2,1-3H3 |
| InChIKey |
JHXHALXLDGXICM-UHFFFAOYSA-N |
| Molecular Weight |
301.224 g/mol |
| SMILES |
C(CCC1=CC=C(C=C1)CBr)(OC)(COC)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.932654 |
![1-(Bromomethyl)-4-[3'-methoxy-3'-(methoxymethyl)butyl]benzene](/api/spectrum/2U3PkfJ8NSv/structure.png?h=300&w=458 "1-(Bromomethyl)-4-[3'-methoxy-3'-(methoxymethyl)butyl]benzene")
