high-resolution electrospray ionisation mass...
URL: https://www.chemotion-repository.net/inchikey/PPLQCTWVGRNGFQ-UHFFFAOYSA-N/CHMO0000485
Dataset description:
dataset for high-resolution electrospray ionisation mass spectrometry (HRESIMS)\n\n
Source: high-resolution electrospray ionisation mass spectrometry (HRESIMS)
Chemical Info
| InChI | InChI=1S/C18H18O6/c1-22-10-4-5-13-15-11-12(17(20)23-2)7-8-14(15)18(21)24-16(13)6-3-9-19/h7-8,11,19H,3,6,9-10H2,1-2H3 |
|---|---|
| SMILES | OCCCc1oc(=O)c2c(c1C#CCOC)cc(cc2)C(=O)OC |
| InChI Key | PPLQCTWVGRNGFQ-UHFFFAOYSA-N |
| Molecular Formula | C18H18O6 |
| Exact Mass | 330.332 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 | def67ef2-ee09-4227-bd68-296dace076c2 |
| Package id | 10-14272-pplqctwvgrngfq-uhfffaoysa-n-chmo0000485 |
| Resource type | HTML |
| State | active |