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STEREQUINONE_G
SpectraBase Compound ID 1Jv9ZwoOQkM
InChI InChI=1S/C20H18O4/c1-11(21)4-5-13-6-8-16-18(12(13)2)20(23)17-10-14(24-3)7-9-15(17)19(16)22/h6-10H,4-5H2,1-3H3
InChIKey JNPVZLURHZXTGF-UHFFFAOYSA-N
Mol Weight 322.36 g/mol
Molecular Formula C20H18O4
Exact Mass 322.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8TTrImDeVfT
Name Sterequinone G
Appearance Pale yellow semisolid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H18O4
InChI InChI=1S/C20H18O4/c1-11(21)4-5-13-6-8-16-18(12(13)2)20(23)17-10-14(24-3)7-9-15(17)19(16)22/h6-10H,4-5H2,1-3H3
InChIKey JNPVZLURHZXTGF-UHFFFAOYSA-N
Instrument Name VG 70-70 micromass
Ionization Type EI
Literature Reference DOI 10.1021/np058036y
Molecular Weight 322.360 g/mol
Reported Formula C20H18O4
SMILES c1(cc2c(cc1)C(c1c(C2=O)c(c(cc1)CCC(C)=O)C)=O)OC
SPLASH splash10-0pc1-9415000000-d8a69eb4446e352c7509
Source of Spectrum G4-68-1619-2
Wiley ID 1881956