SpectraBase Spectrum ID |
DKp0z61Aama |
Name |
1-(3-Methoxyprop-1-enyl)-2-benzylbenzene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
238.135765199 u |
Formula |
C17H18O |
InChI |
InChI=1S/C17H18O/c1-18-13-7-12-16-10-5-6-11-17(16)14-15-8-3-2-4-9-15/h2-12H,13-14H2,1H3/b12-7+ |
InChIKey |
QDXJVDQYXYIDRU-KPKJPENVSA-N |
Molecular Weight |
238.330 g/mol |
SMILES |
C=1(C(\C=C\COC)=CC=CC1)CC=1C=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.936835 |