Dataset

Bucharaine

This MassBank record with Accession MSBNK-Washington_State_Univ-BML00034 contains the MS2 mass spectrum of Bucharaine with the InChIkey PBWIOAMUZKICDN-JLHYYAGUSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C19H25NO4/c1-13(8-9-17(21)19(2,3)23)10-11-24-16-12-18(22)20-15-7-5-4-6-14(15)16/h4-7,10,12,17,21,23H,8-9,11H2,1-3H3,(H,20,22)/b13-10+
SMILES C/C(=C\COC1=CC(=O)NC2=CC=CC=C21)/CCC(C(C)(C)O)O
InChI Key PBWIOAMUZKICDN-JLHYYAGUSA-N
Molecular Formula C19H25NO4
Exact Mass 331.178 g/mol

Data and Resources

Metadata Information

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License URL https://creativecommons.org/licenses/by-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Washington_State_Univ-BML00034
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MetadataCreated 2024-01-11T22:23:21.732446
MetadataModified 2025-02-09T20:11:10.740722
MetadataPublished 2016-01-19
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