Systematic / IUPAC Name: [1-(3,4-dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-yl] acetate
ID: Reference7661
Other Names:
Formula: C22H28O7
[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.
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 |
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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Other Names |
PubChem | 102571606 |