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Aristogin D
SpectraBase Compound ID k51MVigHIg
InChI InChI=1S/C16H14O6/c1-20-15(18)10-3-6-12(7-4-10)22-14-9-11(16(19)21-2)5-8-13(14)17/h3-9,17H,1-2H3
InChIKey CQCOTVWRFOWWDM-UHFFFAOYSA-N
Mol Weight 302.28 g/mol
Molecular Formula C16H14O6
Exact Mass 302.079038 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CKXFYixDaqE
Name Aristogin-D
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14O6
InChI InChI=1S/C16H14O6/c1-20-15(18)10-3-6-12(7-4-10)22-14-9-11(16(19)21-2)5-8-13(14)17/h3-9,17H,1-2H3
InChIKey CQCOTVWRFOWWDM-UHFFFAOYSA-N
Instrument Name VG 70-250 S
Ionization Type EI
Literature Reference DOI 10.1021/np020218u
Molecular Weight 302.282 g/mol
Reported Formula C16H14O6
SMILES Oc1ccc(cc1Oc1ccc(cc1)C(OC)=O)C(OC)=O
SPLASH splash10-0fk9-0189000000-f5af207ad4d383099809
Source of Spectrum G4-65-1524-8
Wiley ID 1883502