![trans-2-(1,3-Dioxolan-2-yl)-10-(2-pivaloyloxyethyl)-tricyclo[8.4.0.0(2,7)]tetradec-11-ene 6,6-Ethylidene Acetal isomer](/api/spectrum/LkkDb4TjJfv/structure.png?h=300&w=458 "trans-2-(1,3-Dioxolan-2-yl)-10-(2-pivaloyloxyethyl)-tricyclo[8.4.0.0(2,7)]tetradec-11-ene 6,6-Ethylidene Acetal isomer")
| SpectraBase Compound ID | 29cbNTn7Hfb |
|---|---|
| InChI | InChI=1S/C26H40O6/c1-23(2,3)21(27)28-14-13-24-9-5-4-7-19(24)25(22-29-15-16-30-22)10-6-11-26(20(25)8-12-24)31-17-18-32-26/h5,9,19-20,22H,4,6-8,10-18H2,1-3H3/t19-,20+,24-,25-/m1/s1 |
| InChIKey | ZGBWTUZFBGKSTP-GCYXNMHMSA-N |
| Mol Weight | 448.6 g/mol |
| Molecular Formula | C26H40O6 |
| Exact Mass | 448.282489 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | LkkDb4TjJfv |
|---|---|
| Name | trans-2-(1,3-Dioxolan-2-yl)-10-(2-pivaloyloxyethyl)-tricyclo[8.4.0.0(2,7)]tetradec-11-ene 6,6-Ethylidene Acetal isomer |
| Alternate Name(s) | 2,2-Dimethylpropanoic acid 2-[(4'aR,4'bR,8'aR,10'aS)-4'a-(1,3-dioxolan-2-yl)-8'a-spiro[1,3-dioxolane-2,1'-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthrene]yl]ethyl ester 2-[(4'aR,4'bR,8'aR,10'aS)-4'a-(1,3-dioxolan-2-yl)spiro[1,3-dioxolane-2,1'-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthrene]-8'a-yl]ethyl 2,2-dimethylpropanoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C26H40O6 |
| InChI | InChI=1S/C26H40O6/c1-23(2,3)21(27)28-14-13-24-9-5-4-7-19(24)25(22-29-15-16-30-22)10-6-11-26(20(25)8-12-24)31-17-18-32-26/h5,9,19-20,22H,4,6-8,10-18H2,1-3H3/t19-,20+,24-,25-/m1/s1 |
| InChIKey | ZGBWTUZFBGKSTP-GCYXNMHMSA-N |
| Molecular Weight | 448.600 g/mol |
| SMILES | [C@@]12([C@@](C3(OCCO3)CCC1)(CC[C@@]1([C@]2(CCC=C1)[H])CCOC(C(C)(C)C)=O)[H])C1OCCO1 |
| SPLASH | splash10-00dj-9000000000-16d3bb5baf45a9c41d8a |
| Source of Spectrum | F-62-7065-5 |
| Wiley ID | 1639868 |