[1-(3,4-dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-yl] acetate

Systematic / IUPAC Name: [1-(3,4-dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-yl] acetate

ID: Reference7661

Other Names:

Formula: C22H28O7

Spectral Data

[1-(3,4-dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-yl] acetate 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 3/29/2018 10:37:01 AM
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Identificators

InChI InChI=1S/C22H28O7/c1-14(23)29-17(6-4-3-5-15-8-10-18(24)19(25)11-15)9-7-16-12-20(26)22(27)21(13-16)28-2/h8,10-13,17,24-27H,3-7,9H2,1-2H3
InChI Key ISMTYWQWKQRTNM-UHFFFAOYSA-N
Canonical SMILES CC(=O)OC(CCCCC1=CC(=C(C=C1)O)O)CCC2=CC(=C(C(=C2)OC)O)O
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In Other Databases

PubChem 102571606