Dataset
DEET
Chemical Info
InChI | InChI=1S/C12H17NO/c1-4-13(5-2)12(14)11-8-6-7-10(3)9-11/h6-9H,4-5H2,1-3H3 |
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SMILES | CCN(CC)C(=O)C1=CC(C)=CC=C1 |
InChI Key | MMOXZBCLCQITDF-UHFFFAOYSA-N |
Molecular Formula | C12H17NO |
Exact Mass | 191.131 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | |
License URL | |
Source | https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-CASMI_2016-SM879706 |
Version | |
Author | |
Maintainer | |
Language | |
MetadataCreated | 2024-01-11T12:42:19.139054 |
MetadataModified | 2024-01-11T12:42:19.307516 |
MetadataPublished | 2016-12-12 |
Field | Value |
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Measurement Technique | liquid chromatography-mass spectrometry |
Measurement Variables |