Dataset
Estrone 3-methyl ether
Chemical Info
InChI | InChI=1S/C19H24O2/c1-19-10-9-15-14-6-4-13(21-2)11-12(14)3-5-16(15)17(19)7-8-18(19)20/h4,6,11,15-17H,3,5,7-10H2,1-2H3/t15-,16-,17+,19+/m1/s1 |
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SMILES | C[C@]12CC[C@@H]3c4ccc(cc4CC[C@H]3[C@@H]1CCC2=O)OC |
InChI Key | BCWWDWHFBMPLFQ-VXNCWWDNSA-N |
Molecular Formula | C19H24O2 |
Exact Mass | 284.178 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-CSL2311093348 |
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Author | |
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MetadataCreated | 2024-01-11T11:30:31.438602 |
MetadataModified | 2024-01-11T11:30:31.686664 |
MetadataPublished | 2023-11-09 |
Field | Value |
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Measurement Technique | liquid chromatography-mass spectrometry |
Measurement Variables |