high resolution fast-atom bombardment mass...
URL: https://www.chemotion-repository.net/inchikey/ZTXJEKUSJCAIBH-AJHHPMMLSA-N/CHMO0000726
Dataset description:
dataset for high resolution fast-atom bombardment mass spectrometry (HRFABMS)\n\n
Source: high resolution fast-atom bombardment mass spectrometry (HRFABMS)
Chemical Info
| InChI | InChI=1S/C36H54O3S/c1-8-27(24(2)3)12-11-26(5)32-17-18-33-31-16-13-28-23-29(39-40(37,38)30-14-9-25(4)10-15-30)19-21-35(28,6)34(31)20-22-36(32,33)7/h9-15,24,26-27,29,31-34H,8,16-23H2,1-7H3/b12-11+/t26-,27-,29+,31+,32-,33+,34+,35+,36-/m1/s1 |
|---|---|
| SMILES | CC[C@@H](C(C)C)/C=C/[C@H]([C@H]1CC[C@@H]2[C@]1(C)CC[C@H]1[C@H]2CC=C2[C@]1(C)CC[C@@H](C2)OS(=O)(=O)c1ccc(cc1)C)C |
| InChI Key | ZTXJEKUSJCAIBH-AJHHPMMLSA-N |
| Molecular Formula | C36H54O3S |
| Exact Mass | 566.877 g/mol |
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Additional Information
| Field | Value |
|---|---|
| Data last updated | September 7, 2024 |
| Metadata last updated | September 7, 2024 |
| Created | September 7, 2024 |
| Format | HTML |
| License | No License Provided |
| Id | b2d21762-ad41-423f-b8f1-9c97e70da03e |
| Package id | 10-14272-ztxjekusjcaibh-ajhhpmmlsa-n-chmo0000726 |
| Resource type | HTML |
| State | active |