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4-O-(2-Methyl-2-butenyl)-3,5-diacetoxybenzoic Acid Methyl Ester
SpectraBase Compound ID YLlnUoIbW5
InChI InChI=1S/C17H20O7/c1-6-10(2)9-22-16-14(23-11(3)18)7-13(17(20)21-5)8-15(16)24-12(4)19/h6-8H,9H2,1-5H3
InChIKey RJFPHVVPXUXSEO-UHFFFAOYSA-N
Mol Weight 336.34 g/mol
Molecular Formula C17H20O7
Exact Mass 336.120903 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CcpfRiudbHe
Name 4-O-(2-Methyl-2-butenyl)-3,5-diacetoxybenzoic Acid Methyl Ester
Appearance gum
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Formula C17H20O7
InChI InChI=1S/C17H20O7/c1-6-10(2)9-22-16-14(23-11(3)18)7-13(17(20)21-5)8-15(16)24-12(4)19/h6-8H,9H2,1-5H3
InChIKey RJFPHVVPXUXSEO-UHFFFAOYSA-N
Instrument Name VG Auto Spec-3000
Ionization Type EI
Literature Reference DOI 10.1021/np0200257
Molecular Weight 336.340 g/mol
Reported Formula C17H20O7
SMILES c1(cc(cc(c1OCC(=CC)C)OC(C)=O)C(=O)OC)OC(=O)C
SPLASH splash10-0159-9540000000-700e8520d1725b119677
Source of Spectrum G4-65-907-28
Wiley ID 1883725