infrared absorption spectroscopy (IR)
URL: https://www.chemotion-repository.net/inchikey/RUTFIUMIIJWKMA-AMFGRPEHSA-N/IR
Dataset description:
dataset for infrared absorption spectroscopy (IR)\n\n
Chemical Info
InChI | InChI=1S/C28H38O4/c1-18(29)32-25-16-28(3)20(15-24(25)30)9-10-21-22-11-12-26(27(22,2)14-13-23(21)28)31-17-19-7-5-4-6-8-19/h4-8,20-23,25-26H,9-17H2,1-3H3/t20-,21-,22-,23-,25-,26-,27-,28-/m0/s1 |
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SMILES | CC(=O)O[C@H]1C[C@@]2(C)[C@H](CC1=O)CC[C@@H]1[C@@H]2CC[C@]2([C@H]1CC[C@@H]2OCc1ccccc1)C |
InChI Key | RUTFIUMIIJWKMA-AMFGRPEHSA-N |
Molecular Formula | C28H38O4 |
Exact Mass | 438.599 g/mol |
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Additional Information
Field | Value |
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Data last updated | September 7, 2024 |
Metadata last updated | September 7, 2024 |
Created | September 7, 2024 |
Format | HTML |
License | No License Provided |
Id | ff7719c4-e1d4-4657-9818-c12dcdbc82db |
Package id | 10-14272-rutfiumiijwkma-amfgrpehsa-n-ir |
Resource type | HTML |
State | active |