![(+-)-(8R,8'R)-[9,9'-2H2,OC2H3]Pinoresinol](/api/spectrum/FpUBrpnd79t/structure.png?h=300&w=458 "(+-)-(8R,8'R)-[9,9'-2H2,OC2H3]Pinoresinol")
| SpectraBase Compound ID | 8qGyqCtfDOC |
|---|---|
| InChI | InChI=1S/C20H22O6/c1-23-17-7-11(3-5-15(17)21)19-13-9-26-20(14(13)10-25-19)12-4-6-16(22)18(8-12)24-2/h3-8,13-14,19-22H,9-10H2,1-2H3/t13-,14-,19+,20+/m1/s1/i3D,4D,5D,6D,7D,8D,9D2,10D2 |
| InChIKey | HGXBRUKMWQGOIE-OPVVKYFUSA-N |
| Mol Weight | 368.45 g/mol |
| Molecular Formula | C20H12D10O6 |
| Exact Mass | 368.204406 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | FpUBrpnd79t |
|---|---|
| Name | (+-)-(8R,8'R)-[9,9'-2H2,OC2H3]Pinoresinol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H12D10O6 |
| InChI | InChI=1S/C20H22O6/c1-23-17-7-11(3-5-15(17)21)19-13-9-26-20(14(13)10-25-19)12-4-6-16(22)18(8-12)24-2/h3-8,13-14,19-22H,9-10H2,1-2H3/t13-,14-,19+,20+/m1/s1/i3D,4D,5D,6D,7D,8D,9D2,10D2 |
| InChIKey | HGXBRUKMWQGOIE-OPVVKYFUSA-N |
| Molecular Weight | 368.451 g/mol |
| SMILES | Oc1c(c(c([C@]2([C@]3([C@]([C@](c4c(c(c(c(c4[D])OC)O)[D])[D])(OC3([D])[D])[H])(C(O2)([D])[D])[H])[H])[H])c(c1OC)[D])[D])[D] |
| SPLASH | splash10-0uxr-0901000000-31ba24d658e1b1f9e4ba |
| Source of Spectrum | AT-35-4733-0 |
| Wiley ID | 852884 |