| SpectraBase Compound ID | GzvRpNyrTas |
|---|---|
| InChI | InChI=1S/C42H56O3SSi/c1-32(27-30-45-47(40(3,4)5,35-21-14-10-15-22-35)36-23-16-11-17-24-36)31-37(46(43,44)34-19-12-9-13-20-34)39-33(2)25-26-38-41(6,7)28-18-29-42(38,39)8/h9-17,19-25,27,37-39H,18,26,28-31H2,1-8H3/b32-27+/t37-,38+,39-,42+/m1/s1 |
| InChIKey | LOHOVYYUKYLUNW-PSLRGLCRSA-N |
| Mol Weight | 669.1 g/mol |
| Molecular Formula | C42H56O3SSi |
| Exact Mass | 668.371943 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5t4bTlAUAVZ |
|---|---|
| Name | (11R,13E)-11-Benzenesulfonyl-15-(tert-butyldiphenylsilyloxy)labda-7,13-diene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 668.371943369 u |
| Formula | C42H56O3SSi |
| InChI | InChI=1S/C42H56O3SSi/c1-32(27-30-45-47(40(3,4)5,35-21-14-10-15-22-35)36-23-16-11-17-24-36)31-37(46(43,44)34-19-12-9-13-20-34)39-33(2)25-26-38-41(6,7)28-18-29-42(38,39)8/h9-17,19-25,27,37-39H,18,26,28-31H2,1-8H3/b32-27+/t37-,38+,39-,42+/m1/s1 |
| InChIKey | LOHOVYYUKYLUNW-PSLRGLCRSA-N |
| SMILES | [C@@](S(=O)(=O)C=1C=CC=CC1)([C@@]1([C@@]2([C@@](C(C)(C)CCC2)([H])CC=C1C)C)[H])(C\C(=C\CO[Si](C(C)(C)C)(C=1C=CC=CC1)C1=CC=CC=C1)C)[H] |