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2-(3-Oxo-1,3-dihydroisobenzofuran-1-ylmethyl)benzoic acid
SpectraBase Compound ID Az9XaAtCU1X
InChI InChI=1S/C16H12O4/c17-15(18)11-6-2-1-5-10(11)9-14-12-7-3-4-8-13(12)16(19)20-14/h1-8,14H,9H2,(H,17,18)
InChIKey QTJSKUCNPMCNDA-UHFFFAOYSA-N
Mol Weight 268.27 g/mol
Molecular Formula C16H12O4
Exact Mass 268.073559 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 87MezRdtGlI
Name 2-(3-OXO-1,3-DIHYDRO-ISOBENZOFURAN-1-YLMETHYL)BENZOIC ACID
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C16H12O4
InChI InChI=1S/C16H12O4/c17-15(18)11-6-2-1-5-10(11)9-14-12-7-3-4-8-13(12)16(19)20-14/h1-8,14H,9H2,(H,17,18)
InChIKey QTJSKUCNPMCNDA-UHFFFAOYSA-N
Molecular Weight 268.0732
SMILES OC(=O)c1ccccc1CC1OC(=O)c2c1cccc2
SPLASH splash10-001i-9620000000-e84d6264c9bd333cd28c
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany