Dataset
Methacetin
Chemical Info
InChI | InChI=1S/C9H11NO2/c1-7(11)10-8-3-5-9(12-2)6-4-8/h3-6H,1-2H3,(H,10,11) |
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SMILES | COc1ccc(NC(C)=O)cc1 |
InChI Key | XVAIDCNLVLTVFM-UHFFFAOYSA-N |
Molecular Formula | C9H11NO2 |
Exact Mass | 165.079 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-CSL2311106568 |
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Author | |
Maintainer | |
Language | |
MetadataCreated | 2024-01-11T11:30:58.557073 |
MetadataModified | 2024-01-11T11:30:58.705294 |
MetadataPublished | 2023-11-10 |
Field | Value |
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Measurement Technique | liquid chromatography-mass spectrometry |
Measurement Variables |