Dataset
Phenylbutazone
Chemical Info
InChI | InChI=1S/C19H20N2O2/c1-2-3-14-17-18(22)20(15-10-6-4-7-11-15)21(19(17)23)16-12-8-5-9-13-16/h4-13,17H,2-3,14H2,1H3 |
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SMILES | CCCCC1C(=O)N(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3 |
InChI Key | VYMDGNCVAMGZFE-UHFFFAOYSA-N |
Molecular Formula | C19H20N2O2 |
Exact Mass | 308.152 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | |
License URL | |
Source | https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-BAFG-CSL23111011248 |
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MetadataCreated | 2024-01-11T10:56:14.763470 |
MetadataModified | 2024-01-11T10:56:14.927238 |
MetadataPublished | 2023-11-10 |
Field | Value |
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Measurement Technique | liquid chromatography-mass spectrometry |
Measurement Variables |