SpectraBase Spectrum ID |
Iqoh4lJZx1F |
Name |
(S)-5-Allyl-2-((1-(3,4-dimethoxyphenyl)propan-2-yl)oxy)-1,3-dimethoxybenzene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
372.193673997 u |
Formula |
C22H28O5 |
InChI |
InChI=1S/C22H28O5/c1-7-8-16-13-20(25-5)22(21(14-16)26-6)27-15(2)11-17-9-10-18(23-3)19(12-17)24-4/h7,9-10,12-15H,1,8,11H2,2-6H3/t15-/m0/s1 |
InChIKey |
RZMDLBAIWHLFEF-HNNXBMFYSA-N |
Molecular Weight |
372.461 g/mol |
SMILES |
C1(=C(C(=CC(=C1)CC=C)OC)O[C@](CC1=CC(=C(C=C1)OC)OC)(C)[H])OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.977098 |