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Isoxanthohumol

URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-BS-BS003212

Dataset description:

This MassBank record with Accession MSBNK-BS-BS003212 contains the MS2 mass spectrum of Isoxanthohumol with the InChIkey YKGCBLWILMDSAV-UHFFFAOYSA-N.

Source: Isoxanthohumol

Chemical Info

molecular Image

InChI	InChI=1S/C21H22O5/c1-12(2)4-9-15-16(23)10-19(25-3)20-17(24)11-18(26-21(15)20)13-5-7-14(22)8-6-13/h4-8,10,18,22-23H,9,11H2,1-3H3
SMILES	C(C(=C(C(C1=C(C(=C(C2=C1OC(C(C2=O)([H])[H])(C3=C(C(=C(C(=C3[H])[H])O[H])[H])[H])[H])OC([H])([H])[H])[H])O[H])([H])[H])[H])C([H])([H])[H])([H])([H])[H]
InChI Key	YKGCBLWILMDSAV-UHFFFAOYSA-N
Molecular Formula	C21H22O5
Exact Mass	354.147 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-NonCommercial-ShareAlike 4.0 International (CC BY-NC-SA 4.0)
Id	8cfe3fd1-6581-4a0a-8b30-6a1c9e2ae460
Package id	msbnk-bs-bs003212
Resource type	HTML
State	active