SpectraBase Spectrum ID |
3VNbzpTZ7Ts |
Name |
(R)-1-(but-3'-en-2'-yl)-3-Methoxybenzene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
162.104465070 u |
Formula |
C11H14O |
InChI |
InChI=1S/C11H14O/c1-4-9(2)10-6-5-7-11(8-10)12-3/h4-9H,1H2,2-3H3/t9-/m1/s1 |
InChIKey |
XGYAXPNSMVKKBC-SECBINFHSA-N |
Molecular Weight |
162.232 g/mol |
SMILES |
C1=CC(=CC(=C1)[C@@](C=C)(C)[H])OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.851978 |