![Methyl (6'Z)-1'-(Isocopal-12-en-15-yl)-8'-[(t-butyldiphenylsilyl)oxy]-3'-hydroxy-6'-methyloct-6'-ene-2'-carboxylate](/api/spectrum/1qwDySJPRit/structure.png?h=300&w=458 "Methyl (6'Z)-1'-(Isocopal-12-en-15-yl)-8'-[(t-butyldiphenylsilyl)oxy]-3'-hydroxy-6'-methyloct-6'-ene-2'-carboxylate")
| SpectraBase Compound ID | 28W8ZvCDXMh |
|---|---|
| InChI | InChI=1S/C47H70O4Si/c1-34(29-33-51-52(44(3,4)5,36-18-13-11-14-19-36)37-20-15-12-16-21-37)22-26-40(48)38(43(49)50-10)24-25-39-35(2)23-27-42-46(39,8)32-28-41-45(6,7)30-17-31-47(41,42)9/h11-16,18-21,23,29,38-42,48H,17,22,24-28,30-33H2,1-10H3/b34-29-/t38?,39-,40?,41+,42+,46+,47+/m0/s1 |
| InChIKey | DSJFFYIYRRGSBM-UIKKSFTFSA-N |
| Mol Weight | 727.2 g/mol |
| Molecular Formula | C47H70O4Si |
| Exact Mass | 726.504337 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1qwDySJPRit |
|---|---|
| Name | Methyl (6'Z)-1'-(Isocopal-12-en-15-yl)-8'-[(t-butyldiphenylsilyl)oxy]-3'-hydroxy-6'-methyloct-6'-ene-2'-carboxylate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C47H70O4Si |
| InChI | InChI=1S/C47H70O4Si/c1-34(29-33-51-52(44(3,4)5,36-18-13-11-14-19-36)37-20-15-12-16-21-37)22-26-40(48)38(43(49)50-10)24-25-39-35(2)23-27-42-46(39,8)32-28-41-45(6,7)30-17-31-47(41,42)9/h11-16,18-21,23,29,38-42,48H,17,22,24-28,30-33H2,1-10H3/b34-29-/t38?,39-,40?,41+,42+,46+,47+/m0/s1 |
| InChIKey | DSJFFYIYRRGSBM-UIKKSFTFSA-N |
| Molecular Weight | 727.158 g/mol |
| SMILES | OC(C(CC[C@@]1([C@@]2([C@]([C@]3([C@](C(CCC3)(C)C)([H])CC2)C)(CC=C1C)[H])C)[H])C(=O)OC)CC\C(=C/CO[Si](C(C)(C)C)(c1ccccc1)c1ccccc1)C |
| SPLASH | splash10-0002-0910000000-ae072086bd0ec05b6605 |
| Source of Spectrum | PS-54-115-27 |
| Wiley ID | 805200 |