infrared absorption spectroscopy (IR)
URL: https://www.chemotion-repository.net/inchikey/CSMKROZAGQDXRJ-PDKVRDFNSA-N/IR
Dataset description:
dataset for infrared absorption spectroscopy (IR)\n\n
Chemical Info
| InChI | InChI=1S/C27H40O8/c1-15(28)32-14-27-13-24(34-17(3)30)23(33-16(2)29)12-19(27)6-7-20-21-8-9-25(35-18(4)31)26(21,5)11-10-22(20)27/h19-25H,6-14H2,1-5H3/t19-,20-,21-,22-,23+,24+,25-,26-,27+/m0/s1 |
|---|---|
| SMILES | CC(=O)OC[C@]12C[C@@H](OC(=O)C)[C@@H](C[C@@H]1CC[C@@H]1[C@@H]2CC[C@]2([C@H]1CC[C@@H]2OC(=O)C)C)OC(=O)C |
| InChI Key | CSMKROZAGQDXRJ-PDKVRDFNSA-N |
| Molecular Formula | C27H40O8 |
| Exact Mass | 492.602 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 | e8532fa0-671a-468e-b6a1-cfd2201506ae |
| Package id | 10-14272-csmkrozagqdxrj-pdkvrdfnsa-n-ir |
| Resource type | HTML |
| State | active |