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1(3H)-Isobenzofuranone, 3-(2-hydroxy-6-oxo-1-cyclohexenyl)-
SpectraBase Compound ID 2r8cjlv26hM
InChI InChI=1S/C14H12O4/c15-10-6-3-7-11(16)12(10)13-8-4-1-2-5-9(8)14(17)18-13/h1-2,4-5,13,15H,3,6-7H2
InChIKey JEPOJXVWXHDIKK-UHFFFAOYSA-N
Mol Weight 244.25 g/mol
Molecular Formula C14H12O4
Exact Mass 244.073559 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LejVimm8NxU
Name 1(3H)-Isobenzofuranone, 3-(2-hydroxy-6-oxo-1-cyclohexenyl)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H12O4
InChI InChI=1S/C14H12O4/c15-10-6-3-7-11(16)12(10)13-8-4-1-2-5-9(8)14(17)18-13/h1-2,4-5,13,15H,3,6-7H2
InChIKey JEPOJXVWXHDIKK-UHFFFAOYSA-N
Molecular Weight 244.246 g/mol
SMILES OC1=C(C2c3c(C(O2)=O)cccc3)C(=O)CCC1
SPLASH splash10-059j-4910000000-bc350191a21e97eb904d
Source of Spectrum IY-1-4379-2
Synonyms 3-(2-hydroxy-6-oxo-1-cyclohexenyl)-3H-isobenzofuran-1-one 3-(2-hydroxy-6-oxocyclohexen-1-yl)-3H-2-benzofuran-1-one 3-(2-hydroxy-6-oxo-cyclohexen-1-yl)-3H-isobenzofuran-1-one 3-(2-oxidanyl-6-oxidanylidene-cyclohexen-1-yl)-3H-2-benzofuran-1-one
Wiley ID 1651775