SpectraBase Spectrum ID |
5OiOWEO2vVu |
Name |
1,2,12,12A-Tetrahydro-2-isopropenyl-8,9-dimethhoxy[1]benzopyrano-[3,4-furo[2,3-H][1]benzopyran-6(6ah)-one |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
394.141638422 u |
Formula |
C23H22O6 |
InChI |
InChI=1S/C23H22O6/c1-11(2)16-8-14-15(28-16)6-5-12-22(24)21-13-7-18(25-3)19(26-4)9-17(13)27-10-20(21)29-23(12)14/h5-7,9,16,20-21H,1,8,10H2,2-4H3 |
InChIKey |
JUVIOZPCNVVQFO-UHFFFAOYSA-N |
Molecular Weight |
394.423 g/mol |
SMILES |
C1=C(C(=CC=2C3C(C4=C(OC3COC12)C=1CC(OC1C=C4)C(C)=C)=O)OC)OC |
Spectrum/Structure Validation Score (Raman) |
0.883103 |