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5-Isobenzofurancarboxaldehyde, 1,3-dihydro-4,6-dihydroxy-3-oxo-
SpectraBase Compound ID 9EUr1YOvBEZ
InChI InChI=1S/C9H6O5/c10-2-5-6(11)1-4-3-14-9(13)7(4)8(5)12/h1-2,11-12H,3H2
InChIKey OSVPXWRXXKPNTP-UHFFFAOYSA-N
Mol Weight 194.14 g/mol
Molecular Formula C9H6O5
Exact Mass 194.021523 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EkwpVgzzsjR
Name 5-Isobenzofurancarboxaldehyde, 1,3-dihydro-4,6-dihydroxy-3-oxo-
Alternate Name(s) 4,6-dihydroxy-3-oxo-1,3-dihydro-2-benzofuran-5-carbaldehyde 6-Formyl-5,7-dihydroxyphthalide 4,6-dihydroxy-3-oxo-1H-isobenzofuran-5-carboxaldehyde 4,6-dihydroxy-3-oxo-1H-2-benzofuran-5-carbaldehyde 4,6-dihydroxy-3-oxo-1H-isobenzofuran-5-carbaldehyde 4,6-bis(oxidanyl)-3-oxidanylidene-1H-2-benzofuran-5-carbaldehyde
CAS Registry Number 72935-13-8
Comments Less than 3 mono-isotopic peaks
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Formula C9H6O5
InChI InChI=1S/C9H6O5/c10-2-5-6(11)1-4-3-14-9(13)7(4)8(5)12/h1-2,11-12H,3H2
InChIKey OSVPXWRXXKPNTP-UHFFFAOYSA-N
Molecular Weight 194.142 g/mol
SMILES Oc1cc2c(c(c1C=O)O)C(OC2)=O
SPLASH splash10-014i-0900000000-37cf4eb5883bad2e0e46
Source of Spectrum B-40-1848-27
Wiley ID 1190235