| SpectraBase Spectrum ID |
IHaNmkG2GTa |
| Name |
all-cis-2-[bis(3,4-Dimethoxyphenyl)methyl]-5,6-dimethoxy-2-methyl-1,3-indanediol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
510.225368047 u |
| Formula |
C29H34O8 |
| InChI |
InChI=1S/C29H34O8/c1-29(27(30)18-14-24(36-6)25(37-7)15-19(18)28(29)31)26(16-8-10-20(32-2)22(12-16)34-4)17-9-11-21(33-3)23(13-17)35-5/h8-15,26-28,30-31H,1-7H3 |
| InChIKey |
UUNRDRQDHZKTQI-UHFFFAOYSA-N |
| Molecular Weight |
510.583 g/mol |
| SMILES |
C1(C(C(C=2C=C(C(=CC12)OC)OC)O)(C)C(C=1C=C(C(=CC1)OC)OC)C=1C=C(C(=CC1)OC)OC)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.97234 |
![all-cis-2-[Bis(3,4-dimethoxyphenyl)methyl]-5,6-dimethoxy-2-methyl-1,3-indanediol](/api/spectrum/IHaNmkG2GTa/structure.png?h=300&w=458 "all-cis-2-[Bis(3,4-dimethoxyphenyl)methyl]-5,6-dimethoxy-2-methyl-1,3-indanediol")
