FA 18:2+2O
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR309096
Dataset description:
This MassBank record with Accession MSBNK-RIKEN-PR309096 contains the MS2 mass spectrum of FA 18:2+2O with the InChIkey JGUNZIWGNMQSBM-UHFFFAOYSA-N.
Source: FA 18:2+2O
Chemical Info
InChI | InChI=1S/C18H32O4/c1-2-3-4-5-6-8-11-14-17(22-21)15-12-9-7-10-13-16-18(19)20/h6,8,11,14,17,21H,2-5,7,9-10,12-13,15-16H2,1H3,(H,19,20) |
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SMILES | O=C(O)CCCCCCCC(OO)C=CC=CCCCCC |
InChI Key | JGUNZIWGNMQSBM-UHFFFAOYSA-N |
Molecular Formula | C18H32O4 |
Exact Mass | 312.450 g/mol |
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Additional Information
Field | Value |
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Data last updated | January 11, 2024 |
Metadata last updated | January 11, 2024 |
Created | January 11, 2024 |
Format | HTML |
License | Attribution-NonCommercial-ShareAlike 4.0 International (CC BY-NC-SA 4.0) |
Id | d3a5b55d-917a-4559-ac5d-23af07fe3ac8 |
Package id | msbnk-riken-pr309096 |
Resource type | HTML |
State | active |