| SpectraBase Spectrum ID |
46u6yanJDcM |
| Name |
1-(3-Bromanylpropyl)-1,2,3,4-tetrahydronaphthalene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
252.051363547 u |
| Formula |
C13H17Br |
| InChI |
InChI=1S/C13H17Br/c14-10-4-8-12-7-3-6-11-5-1-2-9-13(11)12/h1-2,5,9,12H,3-4,6-8,10H2 |
| InChIKey |
GEDNRYKUXULWCS-UHFFFAOYSA-N |
| Molecular Weight |
253.183 g/mol |
| SMILES |
C1(CCCC=2C=CC=CC12)CCCBr |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.970629 |