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5,7-DIHYDROXY-4-METHYLPHTHALIDE;MT-3

View entire compound with spectra: 1 NMR, and 1 MS (GC)

5,7-DIHYDROXY-4-METHYLPHTHALIDE;MT-3
SpectraBase Compound ID HJkRsyFTapn
InChI InChI=1S/C9H8O4/c1-4-5-3-13-9(12)8(5)7(11)2-6(4)10/h2,10-11H,3H2,1H3
InChIKey GXYQICKPCCBIIX-UHFFFAOYSA-N
Mol Weight 180.16 g/mol
Molecular Formula C9H8O4
Exact Mass 180.042259 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 57sEXLFuMk4
Name 5,7-Dihydroxy-4-methylphthalide
Alternate Name(s) 4-Methyl-5,7-bis(oxidanyl)-3H-2-benzofuran-1-one 5,7-Dihydroxy-4-methyl-3H-2-benzofuran-1-one 5,7-Dihydroxy-4-methyl-3H-isobenzofuran-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H8O4
InChI InChI=1S/C9H8O4/c1-4-5-3-13-9(12)8(5)7(11)2-6(4)10/h2,10-11H,3H2,1H3
InChIKey GXYQICKPCCBIIX-UHFFFAOYSA-N
Molecular Weight 180.159 g/mol
SMILES Oc1c2C(OCc2c(c(c1)O)C)=O
SPLASH splash10-0uyi-5900000000-799af99d0baf698af3b2
Source of Spectrum E2-47-1431-3
Wiley ID 1554996