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Methyl 3-(6-Hydroxy-3-oxo-3H-xanthene-9-yl)-propanoate
SpectraBase Compound ID DQRwnzppRrH
InChI InChI=1S/C17H14O5/c1-21-17(20)7-6-12-13-4-2-10(18)8-15(13)22-16-9-11(19)3-5-14(12)16/h2-5,8-9,18H,6-7H2,1H3
InChIKey LHXKSYNUNMSDHY-UHFFFAOYSA-N
Mol Weight 298.29 g/mol
Molecular Formula C17H14O5
Exact Mass 298.084124 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID k4IMBa0GCE
Name Methyl 3-(6-Hydroxy-3-oxo-3H-xanthene-9-yl)-propanoate
Appearance Red solid
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Exact Mass 298.084123546 u
Formula C17H14O5
GC Column DB-XLB (30 m)
InChI InChI=1S/C17H14O5/c1-21-17(20)7-6-12-13-4-2-10(18)8-15(13)22-16-9-11(19)3-5-14(12)16/h2-5,8-9,18H,6-7H2,1H3
InChIKey LHXKSYNUNMSDHY-UHFFFAOYSA-N
Ionization Type EI positive ion
Literature Reference DOI 10.1021/jo301455n
Reported Formula C17H14O5
SMILES OC1=CC2=C(C=C1)C(=C1C(O2)=CC(C=C1)=O)CCC(OC)=O
SPLASH splash10-000i-0090000000-b6f3247d281faa8b8ed0
Source of Spectrum JOC-78-1841-10 (DOI: 10.1021/jo301455n)
Wiley ID 1912254