Achillin
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Washington_State_Univ-BML80681
Dataset description:
This MassBank record with Accession MSBNK-Washington_State_Univ-BML80681 contains the MS mass spectrum of Achillin with the InChIkey BJPSSVHNEGMBDQ-UHFFFAOYSA-N.
Source: Achillin
Chemical Info
InChI | InChI=1S/C15H18O3/c1-7-4-5-10-9(3)15(17)18-14(10)13-8(2)6-11(16)12(7)13/h6,9-10,13-14H,4-5H2,1-3H3 |
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SMILES | CC1C2CCC(=C3C(C2OC1=O)C(=CC3=O)C)C |
InChI Key | BJPSSVHNEGMBDQ-UHFFFAOYSA-N |
Molecular Formula | C15H18O3 |
Exact Mass | 246.126 g/mol |
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Additional Information
Field | Value |
---|---|
Data last updated | January 11, 2024 |
Metadata last updated | January 11, 2024 |
Created | January 11, 2024 |
Format | HTML |
License | Attribution-ShareAlike 4.0 International (CC BY-SA 4.0) |
Id | 90168c57-b937-4be8-9654-be35b3d0c9f6 |
Package id | msbnk-washington_state_univ-bml80681 |
Resource type | HTML |
State | active |