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Rubone

URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Washington_State_Univ-BML01719

Dataset description:

This MassBank record with Accession MSBNK-Washington_State_Univ-BML01719 contains the MS2 mass spectrum of Rubone with the InChIkey VHCQVGQULWFQTM-UHFFFAOYSA-N.

Source: Rubone; LC-ESI-QTOF; MS2; CE 20 ev; [M+H]+

Chemical Info

molecular Image

InChI	InChI=1S/C20H22O7/c1-23-13-9-15(22)20(19(10-13)27-5)14(21)7-6-12-8-17(25-3)18(26-4)11-16(12)24-2/h6-11,22H,1-5H3
SMILES	COC1=CC(=C(C(=C1)OC)C(=O)C=CC2=CC(=C(C=C2OC)OC)OC)O
InChI Key	VHCQVGQULWFQTM-UHFFFAOYSA-N
Exact Mass	374.137 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	3326d4ec-01c5-491c-b105-2daa4ff4fa4f
Package id	msbnk-washington_state_univ-bml01719
Resource type	HTML
State	active