4,8-Dihydroxy-6-methoxy-3-methyl-3,4-dihydro-1H-isochromen-1-one

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Systematic / IUPAC Name: 4,8-Dihydroxy-6-methoxy-3-methyl-3,4-dihydro-1H-isochromen-1-one

ID: Reference7578

Other Names: 1H-2-Benzopyran-1-one, 3,4-dihydro-4,8-dihydroxy-6-methoxy-3-methyl-

Formula: C11H12O5

Spectral Data

4,8-Dihydroxy-6-methoxy-3-methyl-3,4-dihydro-1H-isochromen-1-one mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 1
No. of Spectra 162
Tandem Spectra MS1, MS2
Ionization Methods NSI
Analyzers FT
Last Modification 3/19/2018 12:02:13 PM
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Identificators

InChI InChI=1S/C11H12O5/c1-5-10(13)7-3-6(15-2)4-8(12)9(7)11(14)16-5/h3-5,10,12-13H,1-2H3
InChI Key MJPSOCVCUXUXLP-UHFFFAOYSA-N
Canonical SMILES CC1C(C2=CC(=CC(=C2C(=O)O1)O)OC)O
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Other Names 1H-2-Benzopyran-1-one, 3,4-dihydro-4,8-dihydroxy-6-methoxy-3-methyl-

In Other Databases

PubChem 45359158
ChemSpider 24022608