two-dimensional nuclear magnetic resonance...
URL: https://www.chemotion-repository.net/inchikey/RPSOUIUISVVWAN-ZKJSLFQJSA-N/CHMO0000598.1
Dataset description:
dataset for two-dimensional nuclear magnetic resonance spectroscopy (2D NMR)\n\n
Source: two-dimensional nuclear magnetic resonance spectroscopy (2D NMR)
Chemical Info
| InChI | InChI=1S/C30H38O4/c1-28-13-10-23(33-18-20-6-4-3-5-7-20)17-22(28)8-9-26-25(28)11-14-29(2)24(12-15-30(26,29)32)21-16-27(31)34-19-21/h3-7,12,16,22-23,25-26,32H,8-11,13-15,17-19H2,1-2H3/t22-,23-,25-,26+,28-,29+,30-/m0/s1 |
|---|---|
| SMILES | O=C1OCC(=C1)C1=CC[C@]2([C@]1(C)CC[C@H]1[C@H]2CC[C@@H]2[C@]1(C)CC[C@@H](C2)OCc1ccccc1)O |
| InChI Key | RPSOUIUISVVWAN-ZKJSLFQJSA-N |
| Molecular Formula | C30H38O4 |
| Exact Mass | 462.620 g/mol |
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Additional Information
| Field | Value |
|---|---|
| Data last updated | September 8, 2024 |
| Metadata last updated | September 8, 2024 |
| Created | September 8, 2024 |
| Format | HTML |
| License | No License Provided |
| Id | 3f1ca7d4-fd49-47d5-9b0c-df2a1dbe8fc9 |
| Package id | 10-14272-rpsouiuisvvwan-zkjslfqjsa-n-chmo0000598-1 |
| Resource type | HTML |
| State | active |