Dataset
Aesculetin
Chemical Info
InChI | InChI=1S/C9H6O4/c10-6-3-5-1-2-9(12)13-8(5)4-7(6)11/h1-4,10-11H |
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SMILES | O=C(C=2)Oc(c1)c(C2)cc(O)c(O)1 |
InChI Key | ILEDWLMCKZNDJK-UHFFFAOYSA-N |
Molecular Formula | C9H6O4 |
Exact Mass | 178.027 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | |
License URL | https://creativecommons.org/licenses/by-nc/4.0 |
Source | https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Fiocruz-FIO00084 |
Version | |
Author | |
Maintainer | |
Language | |
MetadataCreated | 2024-01-11T16:34:49.554612 |
MetadataModified | 2024-01-11T16:34:49.752439 |
MetadataPublished | 2016-01-19 |
Field | Value |
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Measurement Technique | liquid chromatography-mass spectrometry |
Measurement Variables |