![3A,4-Trans-3A,9A-cis-6,7-dimethoxy-4-(3,4-dimethoxyphenyl)-1,3,3A,4,9,9A-hexahydronaphtho[2,3-C]furan](/api/spectrum/C1TEGKGvwCh/structure.png?h=300&w=458 "3A,4-Trans-3A,9A-cis-6,7-dimethoxy-4-(3,4-dimethoxyphenyl)-1,3,3A,4,9,9A-hexahydronaphtho[2,3-C]furan")
| SpectraBase Compound ID | 8RYGfgKFekj |
|---|---|
| InChI | InChI=1S/C22H26O5/c1-23-18-6-5-13(8-19(18)24-2)22-16-10-21(26-4)20(25-3)9-14(16)7-15-11-27-12-17(15)22/h5-6,8-10,15,17,22H,7,11-12H2,1-4H3/t15-,17+,22-/m1/s1 InChI=1S/C22H26O5/c1-23-18-6-5-13(8-19(18)24-2)22-16-10-21(26-4)20(25-3)9-14(16)7-15-11-27-12-17(15)22/h5-6,8-10,15,17,22H,7,11-12H2,1-4H3/t15-,17+,22-/m0/s1 |
| InChIKey | MNYFJOSGQNXLHS-ULYRPOKDSA-N |
| Mol Weight | 370.45 g/mol |
| Molecular Formula | C22H26O5 |
| Exact Mass | 370.178024 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | C1TEGKGvwCh |
|---|---|
| Name | 3A,4-Trans-3A,9A-cis-6,7-dimethoxy-4-(3,4-dimethoxyphenyl)-1,3,3A,4,9,9A-hexahydronaphtho[2,3-C]furan |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 370.178023932 u |
| Formula | C22H26O5 |
| InChI | InChI=1S/C22H26O5/c1-23-18-6-5-13(8-19(18)24-2)22-16-10-21(26-4)20(25-3)9-14(16)7-15-11-27-12-17(15)22/h5-6,8-10,15,17,22H,7,11-12H2,1-4H3/t15-,17+,22-/m1/s1 |
| InChIKey | MNYFJOSGQNXLHS-ULYRPOKDSA-N |
| Molecular Weight | 370.445 g/mol |
| SMILES | C=12C=C(C(=CC1[C@]([C@]1(COC[C@]1(C2)[H])[H])(C=1C=CC(=C(C1)OC)OC)[H])OC)OC |
| Spectrum/Structure Validation Score (Raman) | 0.791613 |