![9-[(BENZYLOXY)-METHYL]-2-[(4-METHOXYBENZYL)-OXY]-ETHYL-3,12-DIMETHYL-1,6,8-TRIOXADISPIRO-[4.1.5.2]-TETRADECAN-12-OL](/api/spectrum/ERO7Xr214gA/structure.png?h=300&w=458 "9-[(BENZYLOXY)-METHYL]-2-[(4-METHOXYBENZYL)-OXY]-ETHYL-3,12-DIMETHYL-1,6,8-TRIOXADISPIRO-[4.1.5.2]-TETRADECAN-12-OL")
| SpectraBase Compound ID | 4gzVptSCdXC |
|---|---|
| InChI | InChI=1S/C31H42O7/c1-23-19-30(37-28(23)14-18-34-20-25-9-11-26(33-3)12-10-25)16-17-31(38-30)29(2,32)15-13-27(36-31)22-35-21-24-7-5-4-6-8-24/h4-12,23,27-28,32H,13-22H2,1-3H3/t23-,27+,28-,29-,30+,31-/m1/s1 |
| InChIKey | FABYOSJKJHPVEM-ZWHHRPMYSA-N |
| Mol Weight | 526.7 g/mol |
| Molecular Formula | C31H42O7 |
| Exact Mass | 526.293054 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ERO7Xr214gA |
|---|---|
| Name | 9-[(BENZYLOXY)-METHYL]-2-[(4-METHOXYBENZYL)-OXY]-ETHYL-3,12-DIMETHYL-1,6,8-TRIOXADISPIRO-[4.1.5.2]-TETRADECAN-12-OL |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H42O7 |
| InChI | InChI=1S/C31H42O7/c1-23-19-30(37-28(23)14-18-34-20-25-9-11-26(33-3)12-10-25)16-17-31(38-30)29(2,32)15-13-27(36-31)22-35-21-24-7-5-4-6-8-24/h4-12,23,27-28,32H,13-22H2,1-3H3/t23-,27+,28-,29-,30+,31-/m1/s1 |
| InChIKey | FABYOSJKJHPVEM-ZWHHRPMYSA-N |
| Literature Reference Author | K.MEILERT,M.A.BRIMBLE |
| Literature Reference Citation | ORG.LETTERS,7,3497(2005) |
| Literature Reference DOI | 10.1021/ol051260u |
| Molecular Weight | 526.670 g/mol |
| Sample ID | 53261 |
| Solvent | CDCl3 |