3-(3-Acetyl-2,6-dihydroxy-5-methylbenzyl)-4-hydroxy-5-methyl-2(5H)-furanone

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Systematic / IUPAC Name: 4-[(3-Acetyl-2,6-dihydroxy-5-methylphenyl)methyl]-3-hydroxy-2-methyl-2H-furan-5-one

ID: Reference7782

Other Names: 2(5H)-Furanone, 3-[(3-acetyl-2,6-dihydroxy-5-methylphenyl)methyl]-4-hydroxy-5-methyl-

Formula: C15H16O6

Spectral Data

3-(3-Acetyl-2,6-dihydroxy-5-methylbenzyl)-4-hydroxy-5-methyl-2(5H)-furanone 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 FAIMS
No. of Spectral Trees 1
No. of Spectra 162
Tandem Spectra MS1, MS2
Ionization Methods NSI
Analyzers FT
Last Modification 4/16/2018 10:38:05 AM
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Identificators

InChI InChI=1S/C15H16O6/c1-6-4-9(7(2)16)14(19)10(12(6)17)5-11-13(18)8(3)21-15(11)20/h4,8,17-19H,5H2,1-3H3
InChI Key YLIUZRWENFNXMA-UHFFFAOYSA-N
Canonical SMILES CC1C(=C(C(=O)O1)CC2=C(C(=CC(=C2O)C)C(=O)C)O)O
CAS
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Other Names 2(5H)-Furanone, 3-[(3-acetyl-2,6-dihydroxy-5-methylphenyl)methyl]-4-hydroxy-5-methyl-

In Other Databases

ChemSpider 22943117
PubChem 54749168