| SpectraBase Spectrum ID |
GgBChmaVO4L |
| Name |
(1S,2R,3R)-1-(3,4-Dimethoxyphenyl)-6,7-dimethoxy-2,3-bis(methoxymethyl)-1,2,3,4-tetrahydronaphthalene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
416.219888744 u |
| Formula |
C24H32O6 |
| InChI |
InChI=1S/C24H32O6/c1-25-13-17-9-16-11-22(29-5)23(30-6)12-18(16)24(19(17)14-26-2)15-7-8-20(27-3)21(10-15)28-4/h7-8,10-12,17,19,24H,9,13-14H2,1-6H3/t17-,19-,24-/m0/s1 |
| InChIKey |
CZZKSEXMNQGXJU-KDLAUNOPSA-N |
| Molecular Weight |
416.514 g/mol |
| SMILES |
C=12[C@](C=3C=C(OC)C(=CC3)OC)([C@@](COC)([C@@](CC1C=C(C(=C2)OC)OC)(COC)[H])[H])[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.951927 |
