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Catechin

URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-IPB_Halle-PB001331

Dataset description:

This MassBank record with Accession MSBNK-IPB_Halle-PB001331 contains the MS2 mass spectrum of Catechin with the InChIkey PFTAWBLQPZVEMU-DZGCQCFKSA-N.

Source: Catechin; LC-ESI-QTOF; MS2; CE:40 eV; [M+H]+

Chemical Info

molecular Image

InChI	InChI=1S/C15H14O6/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7/h1-5,13,15-20H,6H2/t13-,15+/m0/s1
SMILES	C1[C@@H]([C@H](OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)O
InChI Key	PFTAWBLQPZVEMU-DZGCQCFKSA-N
Exact Mass	290.079 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	e4439529-d292-4bc7-845d-7086b3afd21b
Package id	msbnk-ipb_halle-pb001331
Resource type	HTML
State	active