Dataset
(4-METHYLTHIO)BENZYL BENZOATE
Chemical Info
InChI | InChI=1S/C15H14O2S/c1-18-14-9-7-12(8-10-14)11-17-15(16)13-5-3-2-4-6-13/h2-10H,11H2,1H3 |
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SMILES | CSc(c1)ccc(COC(=O)c(c2)cccc2)c1 |
InChI Key | PXRPPQZOKMHYRY-UHFFFAOYSA-N |
Molecular Formula | C15H14O2S |
Exact Mass | 258.071 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | |
License URL | https://creativecommons.org/licenses/by-nc-sa/4.0 |
Source | https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Fac_Eng_Univ_Tokyo-JP009675 |
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Author | |
Maintainer | |
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MetadataCreated | 2024-01-11T15:56:02.973088 |
MetadataModified | 2024-01-11T15:56:03.130460 |
MetadataPublished | 2016-01-19 |
Field | Value |
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Measurement Technique | liquid chromatography-mass spectrometry |
Measurement Variables |