SpectraBase Spectrum ID |
9SP0klHHR58 |
Name |
1,3-Benzenediol, 4-[3,4,8,9-tetrahydro-8-(1-methylethenyl)-2H-furo[2,3-H]-1-benzopyran-3-yl]-, dimethyl ether |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
352.167459249 u |
Formula |
C22H24O4 |
InChI |
InChI=1S/C22H24O4/c1-13(2)20-11-18-19(26-20)8-5-14-9-15(12-25-22(14)18)17-7-6-16(23-3)10-21(17)24-4/h5-8,10,15,20H,1,9,11-12H2,2-4H3 |
InChIKey |
XXZJWYHRWUCIGH-UHFFFAOYSA-N |
Molecular Weight |
352.430 g/mol |
SMILES |
COC=1C(C2COC=3C(=CC=C4OC(C(C)=C)CC34)C2)=CC=C(OC)C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.897572 |