| SpectraBase Spectrum ID |
APQIRCQCGYJ |
| Name |
Diethyl (3R,7aR)-3-(4-hydroxyphenyl)-1,1-dimethyl-4-(1-phenylvinyl)-3,5,7,7a-tetrahydrocyclopenta[c]pyran-6,6(1H)-dicarboxylate |
| Appearance |
Colourless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
490.235538809 u |
| Formula |
C30H34O6 |
| InChI |
InChI=1S/C30H34O6/c1-6-34-27(32)30(28(33)35-7-2)17-23-24(18-30)29(4,5)36-26(21-13-15-22(31)16-14-21)25(23)19(3)20-11-9-8-10-12-20/h8-16,24,26,31H,3,6-7,17-18H2,1-2,4-5H3/t24-,26-/m1/s1 |
| InChIKey |
HAYQCDMSPNADMC-AOYPEHQESA-N |
| Instrument Name |
Finnigan SSQ or 7000 Thermo Deca XP |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201500181 |
| Molecular Weight |
490.596 g/mol |
| Quality |
103 |
| Reported Formula |
C30H34O6 |
| SMILES |
OC1=CC=C([C@]2(OC([C@]3(C(CC(C(OCC)=O)(C3)C(=O)OCC)=C2C(=C)C2=CC=CC=C2)[H])(C)C)[H])C=C1 |
| SPLASH |
splash10-00dl-0912700000-e8b12af2e2b78b664313 |
| Source of Spectrum |
QE-21-SM13-6l (DOI: 10.1002/chem.201500181) |
| Thin-Layer Chromatography |
0.21 (Hex/EtOAc, 5:1) |
| Wiley ID |
1906445 |
![Diethyl (3R,7aR)-3-(4-hydroxyphenyl)-1,1-dimethyl-4-(1-phenylvinyl)-3,5,7,7a-tetrahydrocyclopenta[c]pyran-6,6(1H)-dicarboxylate](/api/spectrum/APQIRCQCGYJ/structure.png?h=300&w=458 "Diethyl (3R,7aR)-3-(4-hydroxyphenyl)-1,1-dimethyl-4-(1-phenylvinyl)-3,5,7,7a-tetrahydrocyclopenta[c]pyran-6,6(1H)-dicarboxylate")
