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Japonin C

View entire compound with spectra: 1 MS (GC)

Japonin C
SpectraBase Compound ID BXbThCb3OmW
InChI InChI=1S/C17H18O5/c1-10-14(18)9-12(17(20)16(10)19)5-4-11-8-13(21-2)6-7-15(11)22-3/h6-9,19H,4-5H2,1-3H3
InChIKey VGXAXKKHXKKLAT-UHFFFAOYSA-N
Mol Weight 302.33 g/mol
Molecular Formula C17H18O5
Exact Mass 302.115424 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 761VSHw9qZC
Name Japonin C
Alternate Name(s) 5-[2'-(2'',5''-Dimethoxyphenyl)ethyl]-3-hydroxy-2-methylcyclohexa-2,5-diene-1,4-dione 5-[2-(2,5-dimethoxyphenyl)ethyl]-3-hydroxy-2-methylbenzo-1,4-quinone
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Formula C17H18O5
InChI InChI=1S/C17H18O5/c1-10-14(18)9-12(17(20)16(10)19)5-4-11-8-13(21-2)6-7-15(11)22-3/h6-9,19H,4-5H2,1-3H3
InChIKey VGXAXKKHXKKLAT-UHFFFAOYSA-N
Molecular Weight 302.326 g/mol
SMILES OC1=C(C(=O)C=C(C1=O)CCc1c(ccc(c1)OC)OC)C
SPLASH splash10-0udi-0903000000-50e776dfc6b8ced3e6e9
Source of Spectrum H-90-324-3
Wiley ID 1590651