high-resolution electrospray ionisation mass...
URL: https://www.chemotion-repository.net/inchikey/VPUJZQDJDXGCRO-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/C17H15NO4/c1-21-9-3-4-13-15-10-12(11-18)6-7-14(15)17(20)22-16(13)5-2-8-19/h6-7,10,19H,2,5,8-9H2,1H3 |
|---|---|
| SMILES | COCC#Cc1c(CCCO)oc(=O)c2c1cc(C#N)cc2 |
| InChI Key | VPUJZQDJDXGCRO-UHFFFAOYSA-N |
| Molecular Formula | C17H15NO4 |
| Exact Mass | 297.305 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 | e5146ffd-dec2-46e6-a3ac-65d55b6478da |
| Package id | 10-14272-vpujzqdjdxgcro-uhfffaoysa-n-chmo0000485 |
| Resource type | HTML |
| State | active |