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alpha-(1-OXO-2-INDANYL)-o-TOLUIC ACID

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 MS (GC)

alpha-(1-OXO-2-INDANYL)-o-TOLUIC ACID
SpectraBase Compound ID AlWfLmSaQvL
InChI InChI=1S/C17H14O3/c18-16-13(9-11-5-1-3-7-14(11)16)10-12-6-2-4-8-15(12)17(19)20/h1-8,13H,9-10H2,(H,19,20)
InChIKey GTRFHPLFAYPTSD-UHFFFAOYSA-N
Mol Weight 266.3 g/mol
Molecular Formula C17H14O3
Exact Mass 266.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID INiT4sdzRtV
Name 2-[(1-ketoindan-2-yl)methyl]benzoic acid
Alternate Name(s) 2-[(3-oxidanylidene-1,2-dihydroinden-2-yl)methyl]benzoic acid 2-[(3-oxo-1,2-dihydroinden-2-yl)methyl]benzoic acid
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Formula C17H14O3
InChI InChI=1S/C17H14O3/c18-16-13(9-11-5-1-3-7-14(11)16)10-12-6-2-4-8-15(12)17(19)20/h1-8,13H,9-10H2,(H,19,20)
InChIKey GTRFHPLFAYPTSD-UHFFFAOYSA-N
Molecular Weight 266.296 g/mol
SMILES OC(c1c(cccc1)CC1C(c2c(C1)cccc2)=O)=O
SPLASH splash10-000t-0290000000-ecb2b1fb35be5db66619
Source of Spectrum KC-61-1360-10
Wiley ID 1627463